data_2lzn_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 2lzn _Structure_validation_residue.Date_analyzed 2016-10-08 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 ' 466' ' ' LEU . . . . . . . . . . . . . 89.0 mt . . . . . 0 N--CA 1.437 -1.091 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 467' ' ' SER . . . . . 0.44 ' HB3' ' OE1' ' A' ' 470' ' ' GLU . 33.0 t -85.46 174.66 9.34 Favored 'General case' 0 C--N 1.272 -2.795 0 CA-C-N 114.461 -1.245 . . . . 0.0 111.889 -171.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 10.0 ptm85 -65.5 -22.86 66.77 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.611 -1.631 . . . . 0.0 110.744 176.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.414 HE21 HG21 ' A' ' 563' ' ' ILE . 51.0 mt-30 -67.27 -34.35 77.24 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 177.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.446 ' HG2' ' ND2' ' A' ' 501' ' ' ASN . 2.3 mp0 -73.86 -23.2 59.58 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.509 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.02 -33.38 70.3 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 106.168 -1.79 . . . . 0.0 106.168 174.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 469' ' ' GLN . . . -67.25 -42.29 84.16 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.492 174.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.7 -60.62 2.96 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 122.37 1.081 . . . . 0.0 109.257 172.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 55.2 mtt180 -52.83 -46.34 67.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 113.66 -1.609 . . . . 0.0 112.466 -178.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -70.89 -36.82 72.92 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -62.95 -29.84 71.11 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 121.577 0.703 . . . . 0.0 110.57 -178.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 91.5 mt -73.23 -7.33 51.0 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.968 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -77.17 -13.67 59.91 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 176.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 54.8 t60 -60.66 137.74 58.15 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 63.2 mt -51.52 123.35 9.67 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-O 122.126 0.965 . . . . 0.0 112.573 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 52.4 mtt -71.74 1.26 7.12 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.286 -1.779 . . . . 0.0 113.502 -170.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -68.08 -44.65 75.82 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 171.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.417 ' CG ' ' HG1' ' A' ' 486' ' ' THR . 48.6 t0 -74.7 58.78 0.82 Allowed 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 126.485 1.914 . . . . 0.0 111.879 -174.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . 0.475 ' HE3' HD22 ' A' ' 511' ' ' LEU . 12.5 mmmm -62.14 -18.01 59.59 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.965 -1.016 . . . . 0.0 113.346 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -57.46 -39.85 77.23 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 171.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.417 ' HG1' ' CG ' ' A' ' 483' ' ' ASP . 19.8 m -60.17 -35.01 74.39 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.843 177.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . 0.454 ' CE1' ' HA ' ' A' ' 508' ' ' PHE . 4.9 t80 -58.62 -51.98 67.61 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-O 121.122 0.487 . . . . 0.0 110.078 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 53.9 tp -70.57 -31.48 68.53 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.809 -176.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -69.5 -42.11 75.2 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.007 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.66 -31.43 57.31 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -178.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -60.39 -51.1 70.91 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.45 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -85.29 -12.11 53.14 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 45.8 m -87.41 -15.16 38.57 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.634 0.731 . . . . 0.0 109.527 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 1.4 p -99.45 176.52 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.415 -2.216 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.01 -175.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -85.01 100.71 11.85 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.469 0.652 . . . . 0.0 111.811 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -65.5 -30.46 71.23 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.486 178.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.8 -72.04 0.21 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.67 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -92.12 -33.43 14.76 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -78.64 -7.59 57.79 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.956 -171.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.3 t -60.73 108.33 0.83 Allowed 'General case' 0 CA--C 1.563 1.445 0 CA-C-O 123.299 1.523 . . . . 0.0 111.235 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.446 ' ND2' ' HG2' ' A' ' 470' ' ' GLU . 54.2 t-20 -93.94 157.65 16.01 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 113.56 -1.655 . . . . 0.0 107.679 -178.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -62.84 -34.04 76.51 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 122.032 0.92 . . . . 0.0 108.821 174.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -60.18 -51.02 71.35 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.683 -1.144 . . . . 0.0 108.76 174.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -60.7 -37.64 82.35 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.859 178.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -63.65 -51.69 64.07 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . . . . . . . . 0.256 25.8 m-85 -62.84 -42.3 99.68 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 177.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . 0.466 ' O ' HD13 ' A' ' 511' ' ' LEU . 92.5 t -63.51 -56.7 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.945 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . 0.454 ' HA ' ' CE1' ' A' ' 487' ' ' PHE . 13.6 t80 -49.27 -48.65 45.81 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 177.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -61.73 -55.9 25.35 Favored 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 123.185 0.594 . . . . 0.0 111.821 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 42.9 t -61.62 -45.71 98.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.688 0.756 . . . . 0.0 110.717 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.475 HD22 ' HE3' ' A' ' 484' ' ' LYS . 10.3 mp -67.67 -31.57 71.63 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.406 -175.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 13.9 t60 -72.31 -32.86 66.92 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.013 176.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.0 -40.81 98.89 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.371 0.605 . . . . 0.0 110.231 -179.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -76.3 -36.64 58.26 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.949 176.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . 0.538 ' HA ' ' HB2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -53.25 -34.04 55.56 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.269 1.027 . . . . 0.0 110.223 177.595 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.59 -18.85 62.2 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.281 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -134.13 -57.76 0.85 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 117.686 -1.606 . . . . 0.0 113.772 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -152.03 107.02 3.25 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 106.028 -1.841 . . . . 0.0 106.028 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . 0.538 ' HB2' ' HA ' ' A' ' 515' ' ' TYR . 28.8 t0 -107.56 96.16 6.2 Favored 'General case' 0 C--N 1.284 -2.267 0 N-CA-C 117.718 2.488 . . . . 0.0 117.718 -163.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -141.96 126.3 17.63 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 113.984 -1.462 . . . . 0.0 107.722 162.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -100.63 132.9 45.78 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -120.19 172.3 7.88 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . 0.439 HG13 HD11 ' A' ' 540' ' ' ILE . 0.9 OUTLIER -52.05 -46.29 42.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 C-N-CA 126.803 2.041 . . . . 0.0 109.877 171.299 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.413 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 2.9 m -51.75 -37.22 50.23 Favored 'General case' 0 N--CA 1.428 -1.533 0 C-N-CA 125.508 1.523 . . . . 0.0 111.627 -176.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -65.23 -50.8 64.46 Favored 'General case' 0 C--O 1.248 0.992 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.799 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . 0.416 ' HB2' HD12 ' A' ' 540' ' ' ILE . . . -65.98 -28.95 69.28 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.384 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.456 ' HA ' HG12 ' A' ' 530' ' ' VAL . 42.7 t -67.97 -35.36 71.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 C-N-CA 125.321 1.448 . . . . 0.0 110.997 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 524' ' ' SER . 98.8 mt-30 -65.9 -30.5 71.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 174.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.477 ' HB3' ' HG2' ' A' ' 536' ' ' ARG . 31.5 m-85 -76.5 9.42 2.71 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 175.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.655 ' HA ' ' CZ ' ' A' ' 536' ' ' ARG . 34.4 m -72.7 12.49 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.637 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 -176.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -108.46 -43.66 4.27 Favored 'General case' 0 C--N 1.276 -2.597 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 170.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 6.5 m -75.51 -144.07 0.02 OUTLIER 'General case' 0 C--N 1.289 -2.05 0 C-N-CA 127.73 2.412 . . . . 0.0 112.512 -178.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . 0.467 ' C ' ' H ' ' A' ' 535' ' ' LEU . 16.8 m120 -26.64 30.94 0.0 OUTLIER 'General case' 0 CA--C 1.469 -2.14 1 C-N-CA 138.99 6.916 . . . . 0.0 118.402 179.017 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . 0.54 ' HA ' ' NE ' ' A' ' 536' ' ' ARG . 9.0 pt-20 -30.07 -5.91 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.752 0 C-N-CA 130.769 3.628 . . . . 0.0 116.904 -175.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.467 ' H ' ' C ' ' A' ' 533' ' ' ASN . 0.0 OUTLIER -68.55 -12.18 60.94 Favored 'General case' 0 CA--C 1.57 1.745 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 163.86 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . 0.655 ' CZ ' ' HA ' ' A' ' 530' ' ' VAL . 3.8 ppt_? -66.8 -28.76 68.64 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 126.65 1.98 . . . . 0.0 109.9 169.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . 0.623 ' N ' ' HD2' ' A' ' 536' ' ' ARG . 43.3 tt0 -77.05 -41.0 44.2 Favored 'General case' 0 CA--C 1.479 -1.77 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 541' ' ' SER . 18.5 m -56.3 -47.73 78.09 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.254 173.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 55.7 tp -57.59 -45.65 85.02 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 122.825 0.45 . . . . 0.0 111.526 176.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . 0.439 HD11 HG13 ' A' ' 523' ' ' ILE . 24.8 mm -61.25 -40.45 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 176.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 541' ' ' SER . . . . . 0.421 ' HB3' ' O ' ' A' ' 538' ' ' THR . 35.9 t -57.24 -41.59 79.85 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 123.543 0.737 . . . . 0.0 110.033 174.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.09 -37.72 88.32 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.164 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -68.7 -32.49 72.34 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-O 121.542 0.687 . . . . 0.0 110.441 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.5 tp60 -67.54 -34.95 78.13 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.122 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -70.61 136.41 49.15 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.68 172.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -102.75 141.72 35.08 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -169.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 87.1 mt -82.55 4.4 24.7 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.068 -1.424 . . . . 0.0 109.193 171.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -73.08 -58.07 3.58 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.955 -1.02 . . . . 0.0 108.71 174.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -74.65 -6.06 46.58 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.226 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -109.22 139.5 21.09 Favored Pre-proline 0 C--N 1.306 -1.287 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.611 177.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . 0.44 ' HD2' ' ND2' ' A' ' 554' ' ' ASN . 16.3 Cg_exo -71.3 152.36 61.14 Favored 'Trans proline' 0 C--O 1.242 0.718 0 N-CA-C 107.166 -1.898 . . . . 0.0 107.166 168.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -76.32 -2.49 31.9 Favored 'General case' 0 CA--C 1.503 -0.833 0 C-N-CA 118.669 -1.212 . . . . 0.0 112.794 -176.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . 0.68 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 44.2 mp0 -74.96 -13.48 60.52 Favored 'General case' 0 C--N 1.278 -2.505 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.032 173.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . 0.44 ' ND2' ' HD2' ' A' ' 551' ' ' PRO . 92.7 m-20 -69.31 -21.56 63.85 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.458 172.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -78.98 -92.74 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.552 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 28.5 pt -58.89 -45.5 91.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -174.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . 0.68 ' HB3' ' O ' ' A' ' 553' ' ' GLU . 3.4 t70 -60.27 -60.75 3.32 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 117.783 0.265 . . . . 0.0 110.509 -178.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.02 -41.77 98.45 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.976 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -54.69 -52.77 61.36 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 124.251 1.02 . . . . 0.0 111.026 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.07 -46.67 90.62 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.518 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -55.33 -46.42 76.36 Favored 'General case' 0 C--O 1.204 -1.296 0 C-N-CA 123.494 0.717 . . . . 0.0 112.503 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . 0.518 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 53.1 t -66.62 -40.42 86.2 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.123 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.414 HG21 HE21 ' A' ' 469' ' ' GLN . 54.1 mt -83.37 -32.78 9.44 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.298 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.75 -174.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -89.88 -8.24 52.35 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.941 -176.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 12.4 pt-20 -76.72 -20.06 56.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 177.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? . . . . . 0 CA--C 1.562 1.416 0 CA-C-N 113.988 -1.46 . . . . 0.0 109.062 179.794 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.5 pp . . . . . 0 C--O 1.241 0.615 0 N-CA-C 116.137 1.903 . . . . 0.0 116.137 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 467' ' ' SER . . . . . 0.433 ' O ' ' HG2' ' A' ' 470' ' ' GLU . 28.8 m -89.14 137.13 32.6 Favored 'General case' 0 N--CA 1.42 -1.959 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.711 -178.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . 0.456 HH21 ' CD ' ' A' ' 565' ' ' GLU . 20.1 ptt180 -60.09 -23.06 63.5 Favored 'General case' 0 C--O 1.26 1.643 0 CA-C-O 122.103 0.954 . . . . 0.0 111.001 176.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.461 ' OE1' ' HD2' ' A' ' 566' ' ' LYS . 0.0 OUTLIER -57.03 -38.17 72.78 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.837 177.361 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.637 ' O ' ' HG2' ' A' ' 474' ' ' ARG . 9.1 pt-20 -71.22 -21.9 62.07 Favored 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 119.281 -0.968 . . . . 0.0 111.699 -174.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -73.1 -39.99 65.35 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -60.75 -40.45 92.5 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.091 175.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . 0.401 ' HG2' ' HA ' ' A' ' 470' ' ' GLU . 49.0 mm-40 -61.16 -35.71 77.86 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.79 176.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.637 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 21.0 mmt85 -58.63 -42.26 87.87 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -71.46 -47.42 55.82 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.581 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -58.43 -34.15 70.48 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 122.231 1.015 . . . . 0.0 110.794 -178.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . 0.407 HD21 HG12 ' A' ' 507' ' ' VAL . 23.7 tp -61.49 -10.62 8.17 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 125.987 1.715 . . . . 0.0 111.776 178.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.567 ' HD2' ' O ' ' A' ' 542' ' ' LEU . 9.0 mmpt? -82.57 -12.17 57.91 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 44.6 m170 -70.96 138.71 50.24 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.861 177.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 95.1 mt -65.62 137.99 57.71 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 121.478 0.656 . . . . 0.0 111.377 -175.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' MET . . . . . 0.478 ' C ' ' HG3' ' A' ' 520' ' ' GLN . 0.9 OUTLIER -67.13 3.28 1.2 Allowed 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.449 -1.251 . . . . 0.0 114.305 -174.235 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . 0.451 ' N ' ' HG3' ' A' ' 520' ' ' GLN . 18.8 tpt180 -66.8 -35.17 79.45 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 172.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -77.5 59.71 1.96 Allowed 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.363 172.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -44.13 -30.3 0.74 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.138 1.375 . . . . 0.0 111.999 177.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -56.73 -58.57 7.51 Favored 'General case' 0 C--O 1.197 -1.663 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.699 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 98.8 m -53.19 -39.35 63.58 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.323 0.649 . . . . 0.0 112.002 -178.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . 0.441 ' CE1' ' HB3' ' A' ' 511' ' ' LEU . 41.6 t80 -54.87 -59.48 4.68 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 121.106 0.479 . . . . 0.0 109.985 177.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 99.6 mt -81.64 -19.22 42.22 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 120.131 -0.628 . . . . 0.0 112.477 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -70.97 -39.09 72.73 Favored 'General case' 0 CA--C 1.5 -0.97 0 C-N-CA 122.702 0.401 . . . . 0.0 110.23 177.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -34.15 53.41 Favored 'General case' 0 N--CA 1.425 -1.679 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -178.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -66.36 -24.02 66.43 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 120.188 -0.605 . . . . 0.0 112.457 172.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -88.75 -27.26 21.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 121.029 0.443 . . . . 0.0 111.728 176.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 50.1 m -75.94 -31.02 58.89 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 121.823 -0.548 . . . . 0.0 110.911 -178.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 34.3 t -106.89 155.54 7.55 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 177.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -93.24 134.75 35.12 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 119.038 -1.065 . . . . 0.0 108.457 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . 0.26 0.1 OUTLIER -89.59 -42.69 11.26 Favored 'General case' 0 C--N 1.285 -2.231 0 N-CA-C 117.55 2.426 . . . . 0.0 117.55 -164.919 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -60.21 -42.64 95.58 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 -165.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -93.81 -22.89 18.39 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 119.135 -1.026 . . . . 0.0 112.099 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -81.79 -26.85 34.05 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.136 0.493 . . . . 0.0 111.37 -174.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 89.5 m -71.81 101.39 2.6 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.553 0.692 . . . . 0.0 111.476 -179.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -78.4 167.86 20.68 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 171.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -58.59 -25.94 63.12 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.357 0.526 . . . . 0.0 110.212 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . 0.647 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 14.8 m80 -57.69 -60.16 4.11 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.76 174.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -61.0 -32.22 71.81 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.055 -0.975 . . . . 0.0 112.004 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -64.37 -46.73 82.11 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 123.332 0.653 . . . . 0.0 110.676 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.647 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.266 13.7 p90 -66.06 -36.83 84.26 Favored 'General case' 0 N--CA 1.437 -1.083 0 C-N-CA 118.255 -1.378 . . . . 0.0 111.862 179.856 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 503' ' ' HIS . 12.9 t -66.5 -53.38 36.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.554 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -48.24 -45.94 34.93 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 124.283 0.989 . . . . 0.0 110.51 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -57.42 -53.56 56.78 Favored 'General case' 0 C--O 1.209 -1.069 0 O-C-N 123.848 0.717 . . . . 0.0 111.649 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.482 HG21 ' O ' ' A' ' 506' ' ' TYR . 21.8 t -55.85 -54.7 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 CA-C-O 121.543 0.687 . . . . 0.0 109.729 -178.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.441 ' HB3' ' CE1' ' A' ' 487' ' ' PHE . 7.4 mp -60.88 -53.96 50.9 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.759 -175.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -65.86 -38.03 87.76 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 123.829 0.852 . . . . 0.0 112.304 -177.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -67.52 -40.63 85.08 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 117.469 0.122 . . . . 0.0 111.18 -176.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -71.58 -49.05 44.14 Favored 'General case' 0 C--O 1.204 -1.342 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -50.88 -39.75 54.77 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.291 1.036 . . . . 0.0 110.451 178.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -62.11 -29.71 70.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.982 -0.553 . . . . 0.0 112.186 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -107.31 -40.43 5.39 Favored 'General case' 0 C--N 1.307 -1.257 0 C-N-CA 119.884 -0.726 . . . . 0.0 111.388 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . 0.409 ' CG ' ' H ' ' A' ' 519' ' ' ASP . 65.6 t30 -128.21 -176.92 3.95 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.809 -167.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . 0.409 ' H ' ' CG ' ' A' ' 518' ' ' ASN . 2.5 p30 -76.41 -154.84 0.05 Allowed 'General case' 0 C--N 1.293 -1.885 0 C-N-CA 128.002 2.521 . . . . 0.0 112.001 177.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . 0.478 ' HG3' ' C ' ' A' ' 481' ' ' MET . 6.1 tt0 -58.51 146.97 33.6 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 125.068 1.347 . . . . 0.0 112.111 -166.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -90.87 146.33 24.01 Favored 'General case' 0 N--CA 1.383 -3.785 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -112.98 157.62 21.27 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.062 -176.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.6 pp -72.11 -10.81 14.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.676 0.751 . . . . 0.0 110.601 178.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 19.4 m -58.38 -38.35 77.12 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.203 170.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -65.12 -36.11 83.25 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.032 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -61.57 -48.84 79.13 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.2 177.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.424 ' O ' HG21 ' A' ' 530' ' ' VAL . 10.6 p -68.36 -28.47 40.7 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-O 121.324 0.583 . . . . 0.0 110.961 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -74.51 -12.14 60.4 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.559 -0.713 . . . . 0.0 110.633 173.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -29.28 47.17 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.424 HG21 ' O ' ' A' ' 527' ' ' VAL 0.337 30.1 m -73.93 54.02 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -173.592 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -107.07 -29.06 9.62 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 173.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 13.0 m -90.33 155.48 18.94 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 172.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -69.12 -73.76 0.14 Allowed 'General case' 0 C--O 1.203 -1.359 0 N-CA-C 116.483 2.031 . . . . 0.0 116.483 -172.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -80.19 -64.34 1.21 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -164.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 84.5 mt -57.15 -42.49 81.11 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-O 121.702 0.763 . . . . 0.0 112.46 -168.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -79.55 -29.31 41.32 Favored 'General case' 0 N--CA 1.398 -3.044 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.962 -175.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -70.03 -39.97 75.46 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 174.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 40.3 m -54.28 -46.12 72.64 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.892 177.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.88 -43.67 98.15 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.631 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 13.8 mm -62.86 -40.71 89.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 CA-C-O 120.836 0.35 . . . . 0.0 110.923 176.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 541' ' ' SER . . . . . 0.48 ' HA ' HE21 ' A' ' 544' ' ' GLN . 49.1 m -54.1 -41.42 68.28 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.381 174.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.567 ' O ' ' HD2' ' A' ' 478' ' ' LYS . 10.3 mp -66.79 -49.79 64.72 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.611 172.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -54.39 -46.72 73.16 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 125.423 1.489 . . . . 0.0 111.608 -173.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . 0.48 HE21 ' HA ' ' A' ' 541' ' ' SER . 29.0 pt20 -72.78 12.74 0.46 Allowed 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -176.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -67.03 133.39 49.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 172.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -93.31 92.2 7.58 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.883 -0.727 . . . . 0.0 109.48 -177.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 3.5 pp -81.86 -22.78 36.75 Favored 'General case' 0 C--O 1.205 -1.24 0 CA-C-N 115.428 -0.806 . . . . 0.0 112.077 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -75.61 -12.4 60.2 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.932 0.872 . . . . 0.0 110.292 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -71.7 -36.0 70.42 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.454 -1.248 . . . . 0.0 112.26 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -125.16 143.59 44.74 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-O 119.308 -0.377 . . . . 0.0 110.132 -174.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -36.79 129.17 0.49 Allowed 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 124.084 3.189 . . . . 0.0 113.246 174.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -79.93 -15.35 57.49 Favored 'General case' 0 CA--C 1.491 -1.299 0 CA-C-O 122.331 1.062 . . . . 0.0 110.502 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -78.8 -12.79 60.04 Favored 'General case' 0 N--CA 1.401 -2.924 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.137 175.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -74.09 -36.45 64.28 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 175.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -59.04 -60.13 4.36 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.628 -177.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 31.2 pt -57.74 -34.4 47.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 O-C-N 123.34 0.4 . . . . 0.0 111.935 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -62.77 -56.28 18.98 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.868 0.842 . . . . 0.0 109.234 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . 0.625 ' O ' HG21 ' A' ' 562' ' ' VAL . 27.0 t70 -59.45 -50.37 74.19 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.504 -1.225 . . . . 0.0 109.754 178.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.494 ' O ' HD11 ' A' ' 563' ' ' ILE . 78.0 t80 -50.82 -53.51 31.49 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 125.564 1.546 . . . . 0.0 111.973 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . 0.456 ' O ' ' HB3' ' A' ' 564' ' ' ASN . 14.4 p -59.84 -40.14 81.9 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.51 -178.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -62.62 -47.65 82.84 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 123.128 0.571 . . . . 0.0 111.287 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . 0.625 HG21 ' O ' ' A' ' 558' ' ' ASP . 38.2 t -69.81 -30.03 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 C-N-CA 123.87 0.868 . . . . 0.0 112.236 -178.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.494 HD11 ' O ' ' A' ' 559' ' ' TYR . 1.3 mp -86.84 -48.98 15.27 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.489 0 CA-C-O 122.222 1.01 . . . . 0.0 109.346 -172.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . 0.456 ' HB3' ' O ' ' A' ' 560' ' ' VAL . 26.9 t-20 -78.26 4.35 13.0 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.18 -1.373 . . . . 0.0 109.582 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.456 ' CD ' HH21 ' A' ' 468' ' ' ARG . 2.5 tm-20 -65.3 -28.07 69.06 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 172.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . 0.461 ' HD2' ' OE1' ' A' ' 469' ' ' GLN . 68.4 mttm . . . . . 0 N--CA 1.477 0.9 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.068 175.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 5.8 mp . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 467' ' ' SER . . . . . 0.501 ' OG ' ' HB2' ' A' ' 469' ' ' GLN . 21.9 t -111.27 124.16 51.67 Favored 'General case' 0 N--CA 1.405 -2.71 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -169.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -67.3 -28.84 68.33 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 168.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.501 ' HB2' ' OG ' ' A' ' 467' ' ' SER . 1.7 mp0 -68.66 -42.97 77.15 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 124.445 1.098 . . . . 0.0 110.18 -178.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.553 ' OE2' ' HB2' ' A' ' 501' ' ' ASN . 0.7 OUTLIER -68.61 -34.8 76.4 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.266 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -63.49 -36.09 82.6 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.178 172.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -62.65 -33.67 75.51 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.299 0.571 . . . . 0.0 109.91 176.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -73.72 -28.69 61.84 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.808 175.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -69.07 -32.92 72.72 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 173.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -69.4 -40.93 77.06 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.504 174.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.37 -27.78 66.27 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.697 176.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 19.4 mt -69.97 -8.97 53.34 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.522 ' HZ1' ' CD ' ' A' ' 555' ' ' GLU . 59.3 pttt -43.08 -51.13 5.96 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 124.386 1.054 . . . . 0.0 110.289 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . 0.489 ' N ' ' HG3' ' A' ' 478' ' ' LYS . 3.9 p80 46.29 161.31 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 128.488 2.715 . . . . 0.0 116.218 178.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 65.2 mt -143.21 -154.66 0.54 Allowed 'General case' 0 C--N 1.281 -2.407 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 170.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.34 -28.27 19.94 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . 0.626 ' HG3' ' N ' ' A' ' 483' ' ' ASP . 23.2 ptt180 -64.41 -52.96 55.53 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.991 1.317 . . . . 0.0 113.078 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.626 ' N ' ' HG3' ' A' ' 482' ' ' ARG 0.252 1.1 p30 -76.6 31.29 0.13 Allowed 'General case' 0 N--CA 1.419 -1.993 0 N-CA-C 117.172 2.286 . . . . 0.0 117.172 -164.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . 0.489 ' HD2' ' N ' ' A' ' 485' ' ' ASP . 0.1 OUTLIER -67.41 -28.43 67.91 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 170.695 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . 0.489 ' N ' ' HD2' ' A' ' 484' ' ' LYS . 4.7 p-10 -63.05 -44.77 94.92 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.304 174.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.453 ' HB ' ' HB2' ' A' ' 483' ' ' ASP . 43.5 m -65.17 -39.98 93.68 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 124.015 0.926 . . . . 0.0 110.17 -179.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -54.34 -54.46 40.07 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.208 174.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 36.2 tp -66.14 -34.22 77.55 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.671 -177.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -67.68 -31.13 70.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.714 -178.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.61 -41.55 19.35 Favored 'General case' 0 N--CA 1.401 -2.907 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.99 -52.11 66.87 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.264 1.826 . . . . 0.0 110.831 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.39 -20.08 59.15 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.313 -173.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 59.4 m -81.13 -47.23 13.77 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 119.917 -0.713 . . . . 0.0 111.982 -174.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 40.1 t -137.31 123.43 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 C-N-CA 120.464 -0.494 . . . . 0.0 109.813 -175.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -86.63 45.64 1.27 Allowed 'General case' 0 CA--C 1.55 0.965 0 CA-C-O 122.606 1.193 . . . . 0.0 110.146 -177.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 50.9 pttt -89.16 14.83 9.92 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.659 -177.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.27 -11.05 48.1 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 -170.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -84.66 -22.66 29.78 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.875 0.845 . . . . 0.0 109.14 175.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -79.99 -43.58 21.75 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.4 m -54.94 154.05 5.69 Favored 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.876 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.553 ' HB2' ' OE2' ' A' ' 470' ' ' GLU . 12.7 t-20 -66.42 150.02 49.54 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 124.806 1.242 . . . . 0.0 111.496 -174.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -65.41 -21.73 66.7 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.048 0.539 . . . . 0.0 110.313 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . 0.637 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 49.3 m80 -61.43 -44.25 97.45 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -65.78 -31.73 72.87 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.331 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -61.81 -52.93 62.15 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 122.635 0.374 . . . . 0.0 110.594 -178.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.637 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.282 47.0 p90 -66.2 -25.19 66.81 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 117.516 -1.674 . . . . 0.0 111.863 -179.796 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 97.4 t -72.53 -40.38 63.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.367 174.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -48.67 -50.47 32.97 Favored 'General case' 0 C--O 1.199 -1.6 0 C-N-CA 123.399 0.679 . . . . 0.0 109.526 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' A' ' 513' ' ' ASP . 38.6 mt-10 -57.28 -49.7 75.26 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 506' ' ' TYR . 9.9 t -60.43 -53.82 43.51 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.832 0 O-C-N 123.75 0.656 . . . . 0.0 109.262 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 95.8 mt -69.24 -32.29 71.41 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 113.431 0.9 . . . . 0.0 113.431 -174.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -67.07 -49.47 64.99 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . 0.443 ' HB2' ' O ' ' A' ' 509' ' ' GLU . 0.4 OUTLIER -58.55 -38.39 77.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.368 173.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . 0.661 ' O ' ' HA ' ' A' ' 518' ' ' ASN . 13.8 m-85 -75.75 -3.87 37.29 Favored 'General case' 0 C--O 1.186 -2.279 0 C-N-CA 124.886 1.275 . . . . 0.0 114.31 174.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . 0.499 ' O ' ' HB3' ' A' ' 518' ' ' ASN . 2.6 m-85 -82.83 -35.62 26.22 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 121.154 -0.966 . . . . 0.0 110.356 165.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -68.61 -47.17 67.35 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 170.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -99.02 61.45 1.25 Allowed 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 104.752 -2.314 . . . . 0.0 104.752 174.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . 0.661 ' HA ' ' O ' ' A' ' 514' ' ' PHE . 3.1 p-10 -59.61 -151.27 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 128.844 2.858 . . . . 0.0 116.125 -163.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . 0.358 3.3 p30 -31.54 -152.75 0.0 OUTLIER 'General case' 0 N--CA 1.528 3.441 0 N-CA-C 119.605 3.187 . . . . 0.0 119.605 -138.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -53.18 125.07 16.28 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 124.01 1.862 . . . . 0.0 114.937 -145.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.83 176.58 6.21 Favored 'General case' 0 N--CA 1.416 -2.134 0 CA-C-N 109.648 -3.433 . . . . 0.0 110.483 -168.466 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -108.03 136.51 47.6 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -174.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 36.8 pt -79.19 -14.48 13.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 175.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.455 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 37.0 t -57.13 -30.97 64.87 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.642 172.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -63.03 -42.58 99.82 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . 0.413 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -62.17 -45.27 94.17 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.295 177.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.465 ' O ' HG13 ' A' ' 530' ' ' VAL . 61.8 t -62.1 -26.07 39.12 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.702 0 CA-C-O 121.493 0.663 . . . . 0.0 111.186 175.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . 0.53 HE21 ' HA ' ' A' ' 528' ' ' GLN . 0.0 OUTLIER -71.16 -23.53 62.08 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 120.759 -1.213 . . . . 0.0 109.709 174.811 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.439 ' O ' ' HD3' ' A' ' 536' ' ' ARG . 16.2 m-85 -70.61 -31.71 68.78 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.901 174.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.465 HG13 ' O ' ' A' ' 527' ' ' VAL 0.326 14.6 p -74.97 54.73 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.321 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -172.406 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -107.02 -42.26 4.95 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 173.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 11.7 m -79.0 141.44 37.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 106.004 -1.85 . . . . 0.0 106.004 171.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -68.11 -84.0 0.03 OUTLIER 'General case' 0 C--O 1.198 -1.641 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 -173.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -52.63 -64.98 0.64 Allowed 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 116.113 1.894 . . . . 0.0 116.113 -166.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 44.8 tp -57.14 -57.05 14.3 Favored 'General case' 0 C--O 1.267 2.004 0 CA-C-O 122.579 1.18 . . . . 0.0 111.299 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . 0.439 ' HD3' ' O ' ' A' ' 529' ' ' TYR . 62.8 mtt85 -76.19 -38.25 56.79 Favored 'General case' 0 N--CA 1.41 -2.462 0 CA-C-N 114.11 -1.405 . . . . 0.0 113.686 -171.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -61.27 -43.88 98.15 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 118.243 0.474 . . . . 0.0 110.042 175.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.488 ' O ' HD11 ' A' ' 542' ' ' LEU . 93.4 m -55.44 -43.39 75.37 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 123.779 0.674 . . . . 0.0 111.045 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . 0.453 ' HB2' ' OH ' ' A' ' 506' ' ' TYR . 0.4 OUTLIER -57.9 -45.3 86.67 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.514 177.465 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . 0.581 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 1.7 mp -58.28 -43.96 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 CA-C-O 121.009 0.433 . . . . 0.0 110.368 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 19.8 m -54.5 -41.98 70.23 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.211 174.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.488 HD11 ' O ' ' A' ' 538' ' ' THR . 9.1 mp -62.83 -42.12 99.6 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.909 0.484 . . . . 0.0 110.472 175.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . 0.47 ' HA ' ' O ' ' A' ' 478' ' ' LYS . 40.5 tt0 -61.1 -37.23 82.01 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.166 0.986 . . . . 0.0 111.78 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 72.8 mt-30 -68.83 -29.0 67.24 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.138 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -76.96 84.4 3.49 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-O 121.767 0.794 . . . . 0.0 111.576 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -136.87 136.58 38.85 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.568 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 6.8 mp -90.35 23.54 2.9 Favored 'General case' 0 C--N 1.299 -1.596 0 C-N-CA 124.288 1.035 . . . . 0.0 111.209 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.08 -23.34 66.44 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -170.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -70.08 -15.49 62.99 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.891 0.377 . . . . 0.0 111.033 176.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -117.61 118.32 35.26 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -84.63 38.74 0.7 Allowed 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.948 2.432 . . . . 0.0 110.968 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -128.5 48.61 2.29 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -70.03 66.82 0.27 Allowed 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -175.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.07 -21.86 65.87 Favored 'General case' 0 C--O 1.214 -0.789 0 C-N-CA 125.657 1.583 . . . . 0.0 109.114 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . 0.522 ' CD ' ' HZ1' ' A' ' 478' ' ' LYS . 0.7 OUTLIER -45.37 -38.44 5.87 Favored 'General case' 0 C--O 1.197 -1.659 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.89 174.021 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 43.9 mt -70.93 -42.24 77.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 123.283 0.633 . . . . 0.0 109.545 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -60.49 -47.3 86.75 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 121.957 0.884 . . . . 0.0 109.389 176.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -57.64 -48.54 79.18 Favored 'General case' 0 C--O 1.211 -0.954 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.296 175.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.48 ' O ' HG13 ' A' ' 563' ' ' ILE . 27.9 t80 -56.89 -53.86 53.17 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 125.47 1.508 . . . . 0.0 110.42 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 40.4 t -58.4 -54.98 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.225 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.598 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . 0.42 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 2.4 t30 -63.68 -42.78 97.98 Favored 'General case' 0 C--O 1.181 -2.502 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.994 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 2.6 p -65.75 -33.64 64.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 118.158 0.435 . . . . 0.0 112.108 -173.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 559' ' ' TYR . 27.9 mt -84.82 -29.24 6.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.538 0.685 . . . . 0.0 109.567 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -78.47 -36.19 45.61 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.668 -178.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 561' ' ' ASN . 12.3 pt-20 -75.09 -7.65 54.34 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 122.186 0.993 . . . . 0.0 110.401 -177.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? . . . . . 0 N--CA 1.442 -0.842 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.988 177.913 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 92.6 mt . . . . . 0 N--CA 1.428 -1.559 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 467' ' ' SER . . . . . 0.531 ' O ' ' HG2' ' A' ' 470' ' ' GLU . 47.3 t -95.05 141.09 29.1 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.681 -174.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -65.67 -22.42 66.64 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.252 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -62.26 -36.93 83.57 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.46 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 467' ' ' SER . 14.4 pt-20 -74.96 -23.92 58.37 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.723 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -71.35 -36.49 71.52 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -63.04 -48.41 78.83 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -56.66 -41.7 77.71 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.179 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.484 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 9.9 mmt-85 -57.41 -40.89 79.27 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.163 0.506 . . . . 0.0 109.89 175.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . 0.647 ' O ' ' HG3' ' A' ' 478' ' ' LYS . . . -65.54 -40.22 92.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.939 -178.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.57 -48.04 76.48 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.857 0.837 . . . . 0.0 110.81 173.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 31.8 tp -70.26 -3.17 15.84 Favored 'General case' 0 CA--C 1.571 1.761 0 C-N-CA 126.289 1.836 . . . . 0.0 114.456 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.647 ' HG3' ' O ' ' A' ' 475' ' ' ALA . 35.4 mtmm -41.66 -63.47 0.71 Allowed 'General case' 0 N--CA 1.511 2.579 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -172.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . 0.523 ' CG ' ' HA ' ' A' ' 543' ' ' GLU . 0.4 OUTLIER -170.15 89.7 0.16 Allowed 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 121.918 0.866 . . . . 0.0 110.425 -179.447 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.482 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 96.1 mt -133.12 100.27 4.82 Favored 'General case' 0 C--N 1.278 -2.511 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -83.6 -72.68 0.45 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 114.44 -1.255 . . . . 0.0 112.036 -171.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -9.02 50.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 -179.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.516 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 0.7 OUTLIER -70.79 57.67 0.2 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 125.152 1.381 . . . . 0.0 113.957 -177.524 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -54.95 -40.59 70.11 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 123.572 0.749 . . . . 0.0 111.321 178.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -63.39 -44.96 93.2 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.516 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 26.8 m -62.68 -39.06 92.76 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.208 0.203 . . . . 0.0 111.365 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . 0.432 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 61.6 t80 -56.02 -49.64 73.12 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 176.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.9 -31.71 66.67 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.941 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -68.58 -37.71 80.09 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.951 0.9 . . . . 0.0 111.571 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -84.67 -23.66 29.32 Favored 'General case' 0 N--CA 1.413 -2.298 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . 0.432 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.1 OUTLIER -65.12 -46.11 82.32 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 176.213 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.38 -6.91 56.58 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.273 0.559 . . . . 0.0 111.247 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 36.8 t -78.8 -18.4 54.18 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 37.7 t -129.03 98.09 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.93 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.865 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -99.25 -6.75 27.5 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 171.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -88.45 18.87 4.18 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 127.212 2.205 . . . . 0.0 109.62 177.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -61.16 -0.62 0.36 Allowed 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 -172.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -75.75 -12.91 60.27 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 175.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -77.36 -12.84 60.0 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 114.297 -1.319 . . . . 0.0 110.941 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 14.1 p -54.98 133.49 48.46 Favored 'General case' 0 CA--C 1.485 -1.546 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -170.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 43.4 t-20 -73.73 137.9 44.29 Favored 'General case' 0 N--CA 1.413 -2.282 0 N-CA-C 104.551 -2.388 . . . . 0.0 104.551 170.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . 0.437 ' O ' ' HD1' ' A' ' 506' ' ' TYR . 46.4 tt0 -62.23 -18.58 61.54 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 118.858 0.754 . . . . 0.0 110.985 -172.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -60.36 -41.98 94.81 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.054 175.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -63.56 -36.71 84.7 Favored 'General case' 0 C--O 1.209 -1.029 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.229 174.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 1.2 tmtp? -64.11 -36.07 82.83 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.074 -175.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.547 ' O ' HG21 ' A' ' 510' ' ' VAL . 45.6 m-85 -60.3 -54.09 49.87 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.964 172.022 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.82 -48.22 88.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.593 -177.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -49.82 -49.9 47.22 Favored 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 123.363 0.414 . . . . 0.0 111.636 176.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -57.92 -49.11 77.88 Favored 'General case' 0 N--CA 1.461 0.123 0 O-C-N 123.698 0.624 . . . . 0.0 110.413 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.547 HG21 ' O ' ' A' ' 506' ' ' TYR . 60.2 t -55.36 -58.85 3.3 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.561 0 O-C-N 123.786 0.679 . . . . 0.0 110.707 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 9.5 mp -66.27 -44.5 83.41 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.04 -175.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 50.9 t-80 -62.17 -53.06 60.66 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.977 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.4 -29.32 63.63 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -173.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 21.7 m-30 -76.68 -47.55 21.7 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.659 177.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -52.3 -43.55 64.54 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.591 1.156 . . . . 0.0 109.466 176.246 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -68.65 -9.61 51.09 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -121.49 -48.23 2.19 Favored 'General case' 0 C--N 1.313 -1.014 0 O-C-N 121.917 -0.49 . . . . 0.0 111.694 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -121.16 -151.01 0.47 Allowed 'General case' 0 C--N 1.29 -1.984 0 C-N-CA 123.563 0.745 . . . . 0.0 109.386 -177.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.84 -160.62 0.16 Allowed 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -75.56 179.83 5.08 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.988 -0.445 . . . . 0.0 110.173 -178.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -88.55 138.35 31.5 Favored 'General case' 0 N--CA 1.384 -3.729 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -176.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -119.29 175.8 5.63 Favored 'General case' 0 C--N 1.286 -2.183 0 CA-C-N 116.946 -0.115 . . . . 0.0 110.796 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 35.0 pt -68.73 -18.56 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.302 0.573 . . . . 0.0 110.992 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.477 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 3.5 p -59.71 -41.33 90.58 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-O 121.787 0.803 . . . . 0.0 109.741 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -66.82 -36.91 83.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.001 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -59.8 -49.57 77.19 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.273 178.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.421 ' O ' ' HB ' ' A' ' 530' ' ' VAL . 9.5 p -68.15 -23.62 28.98 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.721 0 CA-C-O 120.903 0.382 . . . . 0.0 110.909 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . 0.477 ' HG3' ' O ' ' A' ' 524' ' ' SER . 26.6 mt-30 -67.28 -30.37 70.22 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 173.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.454 ' C ' ' H ' ' A' ' 531' ' ' ASN . 0.3 OUTLIER -83.17 16.59 2.35 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 173.497 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.421 ' HB ' ' O ' ' A' ' 527' ' ' VAL . 5.2 p -71.63 18.89 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 CA-C-O 121.928 0.871 . . . . 0.0 111.729 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . 0.454 ' H ' ' C ' ' A' ' 529' ' ' TYR . 10.4 p30 -107.86 -26.16 10.88 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.579 -0.701 . . . . 0.0 111.036 -178.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 24.8 m -92.2 140.03 30.03 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . 0.545 ' O ' ' HG2' ' A' ' 537' ' ' GLU . 19.3 m120 -57.84 -72.23 0.09 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -170.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -66.39 -32.45 73.85 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 120.67 0.271 . . . . 0.0 111.158 -174.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' A' ' 539' ' ' LEU . 3.7 mm? -61.88 -50.51 71.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.391 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -62.3 -61.53 2.39 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.869 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 533' ' ' ASN . 12.7 pt-20 -61.22 -62.27 1.96 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -173.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.463 ' O ' HD11 ' A' ' 542' ' ' LEU . 75.7 m -65.27 -53.77 39.21 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' A' ' 535' ' ' LEU . 47.4 tp -61.38 -44.03 97.85 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.468 -174.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 57.2 mt -68.18 -34.83 68.68 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.492 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 28.7 t -57.35 -49.22 76.84 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 121.555 0.693 . . . . 0.0 109.477 174.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.463 HD11 ' O ' ' A' ' 538' ' ' THR . 6.5 mp -66.96 -24.41 66.05 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.979 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . 0.523 ' HA ' ' CG ' ' A' ' 479' ' ' HIS . 0.9 OUTLIER -81.42 -64.7 1.13 Allowed 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.04 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -71.67 -59.59 2.68 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.857 -171.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -73.04 90.28 1.5 Allowed 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -173.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -137.26 100.17 4.18 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 173.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 5.5 tt -92.35 -82.54 0.32 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 118.589 -1.244 . . . . 0.0 111.518 -173.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -104.66 -48.99 3.64 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-O 121.743 0.782 . . . . 0.0 112.137 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -68.23 36.25 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 126.842 2.057 . . . . 0.0 113.824 -172.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -54.97 106.11 0.62 Allowed Pre-proline 0 C--O 1.244 0.798 0 C-N-CA 123.479 0.711 . . . . 0.0 112.174 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -92.72 111.55 0.24 Allowed 'Trans proline' 0 N--CA 1.426 -2.443 0 C-N-CA 122.596 2.197 . . . . 0.0 114.389 -173.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -131.26 -54.14 1.03 Allowed 'General case' 0 CA--C 1.494 -1.209 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 172.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -75.02 -50.22 17.23 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 113.853 -1.521 . . . . 0.0 108.585 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -67.1 -24.16 65.91 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 114.27 -1.332 . . . . 0.0 109.052 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . 0.403 ' CD ' ' HB1' ' A' ' 475' ' ' ALA . 6.1 tp10 -68.07 -56.61 8.25 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.58 -177.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 72.8 mt -54.71 -40.92 53.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.21 -51.67 68.79 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.431 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -66.16 -49.45 67.34 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.192 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.581 ' O ' HG12 ' A' ' 563' ' ' ILE . 87.5 t80 -51.49 -53.44 37.37 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 125.352 1.461 . . . . 0.0 110.233 178.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 75.7 t -61.41 -45.92 97.64 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.985 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -58.46 -39.72 80.68 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.741 0.416 . . . . 0.0 111.324 -179.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 76.3 t -70.12 -34.87 61.05 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 123.187 0.595 . . . . 0.0 112.246 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.581 HG12 ' O ' ' A' ' 559' ' ' TYR . 47.7 mm -86.37 -38.32 12.42 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -174.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -76.82 0.14 21.83 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 113.956 -1.475 . . . . 0.0 109.646 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -64.54 -36.17 83.35 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 104.781 -2.303 . . . . 0.0 104.781 173.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 566' ' ' LYS . 54.1 tttm . . . . . 0 CA--C 1.553 1.071 0 CA-C-N 113.525 -1.67 . . . . 0.0 108.27 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 N--CA 1.44 -0.949 0 CA-C-O 121.391 0.615 . . . . 0.0 109.385 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 67.2 p -101.94 -177.84 3.53 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.191 -174.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.3 ptt180 -69.36 -18.19 63.76 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.235 173.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -57.54 -67.62 0.31 Allowed 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 -168.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.464 ' O ' ' HG3' ' A' ' 474' ' ' ARG 0.449 11.7 pt-20 -77.1 -9.06 58.49 Favored 'General case' 0 N--CA 1.421 -1.887 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -177.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -67.07 -44.46 80.03 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 170.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -67.86 -27.78 66.98 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.768 0.794 . . . . 0.0 109.184 176.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . 0.427 ' CB ' ' HA ' ' A' ' 470' ' ' GLU . 0.1 OUTLIER -70.18 -45.14 67.3 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 114.67 -1.15 . . . . 0.0 108.541 177.801 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 67.7 mtt180 -57.06 -35.31 69.19 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.19 0.519 . . . . 0.0 110.89 172.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -69.5 -39.35 77.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.591 175.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . 0.54 ' O ' ' HB2' ' A' ' 479' ' ' HIS . 4.2 t80 -64.49 -38.39 90.84 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 123.69 0.796 . . . . 0.0 110.097 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 56.3 tp -63.47 -43.35 97.57 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.44 1.096 . . . . 0.0 111.162 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -74.61 -53.37 9.49 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . 0.54 ' HB2' ' O ' ' A' ' 476' ' ' PHE . 1.7 t-80 40.05 -97.15 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.096 2.159 . . . . 0.0 113.326 177.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.428 ' H ' ' HB3' ' A' ' 479' ' ' HIS . 3.2 mm? -136.27 153.24 51.25 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 173.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' MET . . . . . 0.556 ' HG3' ' O ' ' A' ' 521' ' ' TYR . 58.7 ttp -54.29 -34.98 62.09 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 122.987 0.515 . . . . 0.0 112.316 -177.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 19.7 ptt-85 -66.83 -17.49 64.91 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -177.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 480' ' ' LEU . 4.6 m-20 -70.55 41.28 0.06 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 116.505 2.039 . . . . 0.0 116.505 -169.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . 0.571 ' HD2' ' CD2' ' A' ' 515' ' ' TYR . 30.6 mmtp -60.88 -42.77 98.59 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-O 121.136 0.493 . . . . 0.0 110.983 174.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -60.93 -50.41 73.52 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.093 178.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 59.3 m -58.32 -43.05 88.03 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 123.952 0.901 . . . . 0.0 111.266 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . 0.501 ' CE1' ' HB3' ' A' ' 511' ' ' LEU . 82.5 t80 -46.19 -55.35 7.23 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.748 1.219 . . . . 0.0 109.893 175.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 60.0 mt -79.02 -27.36 43.23 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -67.07 -41.31 86.64 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.82 -38.7 20.9 Favored 'General case' 0 N--CA 1.424 -1.764 0 C-N-CA 120.116 -0.634 . . . . 0.0 109.786 -177.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 28.9 t80 -55.14 -58.2 8.64 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -77.82 -14.38 59.59 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 120.372 -0.531 . . . . 0.0 112.221 -170.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 43.5 m -82.31 -60.99 2.02 Favored 'General case' 0 N--CA 1.425 -1.68 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -173.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . 0.425 HG11 ' O ' ' A' ' 495' ' ' ASP . 87.6 t -139.14 134.97 41.71 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 120.353 -0.539 . . . . 0.0 112.125 -167.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . 0.425 ' O ' HG11 ' A' ' 494' ' ' VAL . 12.0 m-20 -85.87 158.95 19.82 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 170.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.23 -90.89 0.13 Allowed 'General case' 0 CA--C 1.5 -0.962 0 C-N-CA 116.459 -2.096 . . . . 0.0 112.152 -167.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -106.25 -85.22 0.5 Allowed 'General case' 0 N--CA 1.431 -1.375 0 C-N-CA 114.444 -2.903 . . . . 0.0 113.02 171.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -127.79 -50.67 1.36 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.524 1.53 . . . . 0.0 114.991 171.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . 0.357 10.8 p90 -70.57 -93.15 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.831 1 N-CA-C 123.904 4.779 . . . . 0.0 123.904 -149.646 . . . . . . . . 3 2 . 1 . 005 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 11.4 m -93.45 89.7 6.42 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -161.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -127.25 42.02 3.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 117.769 -1.573 . . . . 0.0 114.227 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . 0.421 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 1.1 tm0? -90.13 -35.06 15.63 Favored 'General case' 0 CA--C 1.502 -0.902 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 168.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . 0.718 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 87.3 m-70 -62.86 -40.64 98.11 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.111 -178.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . 0.456 ' O ' ' HD2' ' A' ' 508' ' ' PHE . 37.2 m-85 -63.85 -40.78 97.37 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.169 175.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.421 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 54.2 tttp -58.77 -50.36 74.21 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 123.688 0.795 . . . . 0.0 109.7 -175.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.718 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.279 9.8 p90 -65.02 -36.62 84.98 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 118.261 -1.375 . . . . 0.0 113.265 178.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.85 -48.75 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 120.311 -0.555 . . . . 0.0 109.802 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . 0.456 ' HD2' ' O ' ' A' ' 504' ' ' PHE . 32.3 m-85 -51.79 -39.39 58.57 Favored 'General case' 0 CA--C 1.499 -0.998 0 O-C-N 123.826 0.704 . . . . 0.0 112.637 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -58.39 -61.17 2.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.747 0.654 . . . . 0.0 109.512 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.417 HG22 ' O ' ' A' ' 506' ' ' TYR . 32.0 t -58.29 -48.94 83.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.389 -176.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.501 ' HB3' ' CE1' ' A' ' 487' ' ' PHE . 2.9 tt -68.61 -40.83 80.23 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.802 -172.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -70.09 -35.11 73.94 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.89 -49.16 77.33 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.172 0.589 . . . . 0.0 110.427 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -63.45 -44.13 95.38 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.952 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . 0.571 ' CD2' ' HD2' ' A' ' 484' ' ' LYS . 0.7 OUTLIER -52.98 -42.32 65.43 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 124.142 0.977 . . . . 0.0 109.773 179.641 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.84 -21.34 63.38 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -116.03 -53.85 2.53 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-O 121.87 0.843 . . . . 0.0 112.198 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . 0.556 ' CG ' ' H ' ' A' ' 519' ' ' ASP . 22.8 t-20 -101.88 -152.36 0.44 Allowed 'General case' 0 C--N 1.281 -2.38 0 CA-C-N 114.161 -1.381 . . . . 0.0 110.248 -169.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . 0.556 ' H ' ' CG ' ' A' ' 518' ' ' ASN . 29.1 t70 -106.17 -158.15 0.64 Allowed 'General case' 0 C--N 1.272 -2.78 0 C-N-CA 128.505 2.722 . . . . 0.0 105.664 -170.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . 0.471 ' HA ' ' NZ ' ' A' ' 484' ' ' LYS 0.412 3.5 pm0 -62.95 155.08 28.38 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 120.501 1.501 . . . . 0.0 112.71 178.25 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . 0.556 ' O ' ' HG3' ' A' ' 481' ' ' MET . 0.3 OUTLIER -84.06 131.46 34.8 Favored 'General case' 0 N--CA 1.397 -3.101 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -167.006 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -72.38 146.51 46.99 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.014 -178.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . 0.45 ' HB ' ' OE2' ' A' ' 543' ' ' GLU . 39.1 pt -84.29 -12.02 11.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.483 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 35.7 t -56.84 -38.54 72.8 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.869 175.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -64.62 -34.45 78.3 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . 0.516 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -61.95 -39.6 92.66 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.114 176.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 56.5 t -71.17 -37.22 65.65 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.115 0 C-N-CA 124.083 0.953 . . . . 0.0 108.729 177.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.2 mm100 -67.3 -10.48 51.3 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 122.711 0.405 . . . . 0.0 111.119 178.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.516 ' HB2' ' O ' ' A' ' 526' ' ' ALA . 4.9 m-85 -71.13 -0.02 8.72 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.645 168.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.518 ' HA ' ' CB ' ' A' ' 536' ' ' ARG . 6.3 p -73.03 15.27 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.642 0 CA-C-O 122.288 1.042 . . . . 0.0 110.469 174.31 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . 0.452 ' H ' ' C ' ' A' ' 529' ' ' TYR . 5.9 t30 -97.12 -24.8 15.58 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 174.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 31.8 t -91.75 141.68 28.41 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 114.963 -1.017 . . . . 0.0 108.785 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -65.86 -51.04 62.17 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -175.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -94.95 -37.83 10.97 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.145 0.498 . . . . 0.0 111.204 -177.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.404 HD22 ' OH ' ' A' ' 506' ' ' TYR . 45.8 mt -66.32 -21.49 66.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.708 -174.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . 0.518 ' CB ' ' HA ' ' A' ' 530' ' ' VAL . 36.3 ptt180 -63.47 -46.42 86.29 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.21 -49.85 75.47 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.525 -178.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.443 ' O ' ' HB2' ' A' ' 541' ' ' SER . 5.7 m -61.01 -54.52 43.95 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -178.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . 0.31 4.2 mm? -65.28 -35.62 81.58 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -177.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 72.1 mt -72.0 -29.64 33.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.91 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 541' ' ' SER . . . . . 0.443 ' HB2' ' O ' ' A' ' 538' ' ' THR . 73.3 m -57.41 -40.76 78.99 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.669 0.747 . . . . 0.0 109.544 168.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -74.67 -13.08 60.58 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . 0.45 ' OE2' ' HB ' ' A' ' 523' ' ' ILE . 53.9 mm-40 -80.47 -40.75 25.63 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.246 0.546 . . . . 0.0 111.146 174.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -77.58 27.36 0.17 Allowed 'General case' 0 CA--C 1.557 1.224 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -176.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -67.84 163.7 21.31 Favored 'General case' 0 C--O 1.242 0.705 0 O-C-N 122.237 -0.289 . . . . 0.0 110.688 177.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . 0.419 ' C ' ' H ' ' A' ' 548' ' ' ASN . 46.3 m-80 -93.1 155.02 17.76 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.876 -0.329 . . . . 0.0 111.307 -177.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . 0.409 ' C ' ' H ' ' A' ' 549' ' ' ASP . 88.2 mt -77.47 22.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.431 1.092 . . . . 0.0 111.952 -179.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . 0.473 ' C ' ' H ' ' A' ' 550' ' ' GLU . 2.6 t-20 -79.8 21.32 0.55 Allowed 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 122.082 0.944 . . . . 0.0 110.183 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . 0.409 ' H ' ' C ' ' A' ' 547' ' ' LEU . 5.2 p-10 -70.08 9.65 0.53 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 125.601 1.56 . . . . 0.0 111.626 178.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.473 ' H ' ' C ' ' A' ' 548' ' ' ASN . 34.9 mt-10 -54.9 154.66 9.33 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 125.917 1.687 . . . . 0.0 111.873 -175.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -71.83 45.16 0.7 Allowed 'Trans proline' 0 N--CA 1.503 2.033 0 C-N-CA 124.666 3.577 . . . . 0.0 112.807 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -134.92 50.49 2.16 Favored 'General case' 0 C--N 1.282 -2.334 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 178.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -56.66 67.35 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 117.153 2.279 . . . . 0.0 117.153 -169.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . 0.454 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 7.6 t30 -70.65 -22.08 62.54 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.919 1.287 . . . . 0.0 107.786 171.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -44.93 -54.53 6.39 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.537 1.535 . . . . 0.0 110.029 177.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 54.6 mt -62.7 -38.86 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.396 0.678 . . . . 0.0 110.284 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . 0.454 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 3.2 t70 -56.57 -51.25 69.32 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 121.071 0.462 . . . . 0.0 110.611 177.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . 0.495 ' O ' HG22 ' A' ' 562' ' ' VAL . 29.6 t70 -67.13 -47.41 71.17 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.999 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.433 ' O ' HD13 ' A' ' 563' ' ' ILE . 77.6 t80 -51.99 -53.37 42.48 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.998 1.319 . . . . 0.0 111.456 179.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.28 -44.24 95.26 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.679 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . 0.471 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 9.3 t30 -63.09 -36.33 83.22 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 122.774 0.43 . . . . 0.0 112.143 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . 0.495 HG22 ' O ' ' A' ' 558' ' ' ASP . 89.7 t -70.97 -50.3 43.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-O 121.591 0.71 . . . . 0.0 111.493 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.538 ' O ' ' HG3' ' A' ' 566' ' ' LYS . 1.7 mp -80.7 -55.5 8.34 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.882 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.465 -168.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -74.57 1.09 12.88 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 122.091 0.948 . . . . 0.0 111.041 -173.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 45.2 tt0 -67.2 -14.71 63.17 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 169.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' A' ' 563' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.357 0.931 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.781 173.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 91.5 mt . . . . . 0 N--CA 1.438 -1.065 0 CA-C-O 120.718 0.294 . . . . 0.0 111.505 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 41.0 t -109.53 104.16 13.17 Favored 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 173.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -70.81 -29.13 65.22 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.551 -0.46 . . . . 0.0 112.2 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -67.65 -54.3 20.77 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.057 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.62 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 32.0 tt0 -63.48 -36.67 84.51 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -58.18 -42.43 86.06 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.483 177.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -65.65 -43.43 89.42 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.089 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.72 -44.5 93.7 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.457 0.703 . . . . 0.0 110.924 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.62 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 92.4 mtt180 -53.46 -54.27 39.4 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.296 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . 0.426 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -69.56 -43.47 72.83 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 124.146 0.903 . . . . 0.0 112.265 -178.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -55.12 -36.65 65.95 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.019 0.927 . . . . 0.0 111.727 -176.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . 0.402 HD13 HG13 ' A' ' 507' ' ' VAL . 1.2 tm? -57.38 -31.34 65.7 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 113.866 -1.516 . . . . 0.0 111.277 -176.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.465 ' HD3' ' O ' ' A' ' 542' ' ' LEU . 12.4 pttt -71.65 -19.87 62.03 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -172.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . 0.401 ' N ' ' HG3' ' A' ' 478' ' ' LYS . 9.0 t-160 -119.92 9.09 11.18 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 118.239 -1.384 . . . . 0.0 112.832 -171.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.435 ' HB2' HG23 ' A' ' 486' ' ' THR 0.264 1.1 pp -91.58 72.07 5.91 Favored 'General case' 0 C--O 1.194 -1.83 0 CA-C-O 122.739 1.256 . . . . 0.0 110.982 175.812 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -98.67 9.45 43.29 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . 0.644 ' O ' ' HG2' ' A' ' 520' ' ' GLN . 97.7 mtt180 -66.56 -97.8 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 119.946 1.248 . . . . 0.0 114.282 -171.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . 0.278 1.1 p30 -143.64 -84.87 0.15 Allowed 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.034 2.235 . . . . 0.0 117.034 168.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt -95.43 -41.3 9.05 Favored 'General case' 0 CA--C 1.485 -1.551 0 CA-C-O 121.893 0.854 . . . . 0.0 109.414 -178.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . 0.454 ' O ' ' HB2' ' A' ' 489' ' ' ASN . 9.7 p-10 -51.1 -38.4 51.6 Favored 'General case' 0 C--O 1.173 -2.965 0 CA-C-N 112.683 -2.053 . . . . 0.0 109.211 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.435 HG23 ' HB2' ' A' ' 480' ' ' LEU . 3.1 m -59.05 -51.44 70.03 Favored 'General case' 0 N--CA 1.419 -1.98 0 C-N-CA 125.907 1.683 . . . . 0.0 113.343 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -66.13 -44.72 83.44 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -174.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 59.4 mt -76.33 -21.75 55.8 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.356 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 485' ' ' ASP . 57.7 t30 -65.6 -40.39 92.59 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 123.008 0.523 . . . . 0.0 109.97 -177.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -83.96 -54.31 4.96 Favored 'General case' 0 N--CA 1.425 -1.704 0 C-N-CA 119.19 -1.004 . . . . 0.0 109.749 175.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -58.92 -35.96 73.96 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -171.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -83.23 -23.14 32.89 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 121.347 0.594 . . . . 0.0 111.347 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 15.8 m -83.98 -41.67 17.06 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -175.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 40.0 t -101.87 161.73 3.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.361 -173.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.81 101.95 14.7 Favored 'General case' 0 CA--C 1.495 -1.169 0 CA-C-O 121.1 0.476 . . . . 0.0 111.352 177.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -57.99 -36.81 73.16 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.929 -176.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -73.74 -28.35 61.65 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -83.36 -56.64 3.64 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 121.744 0.783 . . . . 0.0 109.113 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -77.57 11.64 1.96 Allowed 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -174.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 5.1 m -52.5 99.88 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.753 0.787 . . . . 0.0 111.896 -173.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.46 ' HB3' ' CD2' ' A' ' 504' ' ' PHE . 23.2 t-20 -119.3 154.76 33.01 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 178.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 47.5 tp60 -58.99 -31.8 69.1 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 123.715 0.806 . . . . 0.0 110.312 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -59.01 -53.96 52.46 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 124.181 0.992 . . . . 0.0 108.685 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . 0.46 ' CD2' ' HB3' ' A' ' 501' ' ' ASN . 22.0 m-85 -66.42 -35.1 79.47 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.425 -178.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -64.36 -49.34 72.01 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 123.199 0.599 . . . . 0.0 110.269 -176.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.526 ' O ' HG21 ' A' ' 510' ' ' VAL . 9.2 m-85 -60.09 -54.87 40.81 Favored 'General case' 0 N--CA 1.439 -0.991 0 O-C-N 123.855 0.722 . . . . 0.0 111.953 178.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . 0.478 ' O ' ' HB2' ' A' ' 511' ' ' LEU . 54.5 t -60.48 -48.04 90.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.349 -176.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -49.69 -50.31 44.19 Favored 'General case' 0 C--O 1.218 -0.567 0 O-C-N 123.568 0.543 . . . . 0.0 111.117 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -63.46 -53.73 47.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.526 HG21 ' O ' ' A' ' 506' ' ' TYR . 42.8 t -57.96 -45.95 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 121.217 0.532 . . . . 0.0 110.407 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.478 ' HB2' ' O ' ' A' ' 507' ' ' VAL . 0.4 OUTLIER -66.4 -48.66 69.36 Favored 'General case' 0 N--CA 1.419 -2.001 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.976 -176.352 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -60.01 -42.96 95.45 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.152 0.581 . . . . 0.0 110.651 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -71.15 -43.34 67.73 Favored 'General case' 0 C--N 1.313 -0.991 0 O-C-N 123.405 0.441 . . . . 0.0 112.179 -173.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . 0.405 ' HA ' ' HG2' ' A' ' 517' ' ' GLU . 65.1 m-85 -73.92 -42.16 61.02 Favored 'General case' 0 C--O 1.199 -1.605 0 C-N-CA 119.289 -0.964 . . . . 0.0 111.607 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -54.74 -32.06 59.24 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.454 0.701 . . . . 0.0 110.311 176.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -70.23 -24.37 63.08 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.409 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . 0.405 ' HG2' ' HA ' ' A' ' 514' ' ' PHE . 10.0 pt-20 -110.03 -44.05 3.86 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -176.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . 0.441 ' HB3' ' H ' ' A' ' 519' ' ' ASP . 92.1 m-20 -135.38 -152.16 0.45 Allowed 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 124.355 1.062 . . . . 0.0 109.592 -172.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . 0.441 ' H ' ' HB3' ' A' ' 518' ' ' ASN . 3.4 p-10 -79.32 -164.54 0.64 Allowed 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 125.093 1.357 . . . . 0.0 111.683 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . 0.644 ' HG2' ' O ' ' A' ' 482' ' ' ARG . 0.0 OUTLIER -73.78 -178.79 3.33 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 115.933 1.827 . . . . 0.0 115.933 -171.227 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . 0.422 ' CB ' ' HG ' ' A' ' 511' ' ' LEU . 12.0 t80 -103.21 138.03 40.56 Favored 'General case' 1 N--CA 1.362 -4.863 0 C-N-CA 125.384 1.473 . . . . 0.0 107.49 -177.321 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -118.99 167.79 11.42 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.6 pp -70.36 -8.63 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 121.512 0.672 . . . . 0.0 110.726 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 12.8 m -56.19 -40.47 74.01 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.787 173.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -71.41 -40.51 70.42 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -59.29 -48.11 82.86 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.878 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.657 ' O ' HG11 ' A' ' 530' ' ' VAL . 10.3 p -67.65 -28.55 42.19 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.854 0 CA-C-O 121.314 0.578 . . . . 0.0 110.71 177.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -70.7 -20.77 62.64 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.585 ' O ' ' HG2' ' A' ' 536' ' ' ARG . 2.0 m-85 -74.57 -23.41 58.76 Favored 'General case' 0 CA--C 1.494 -1.184 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.657 HG11 ' O ' ' A' ' 527' ' ' VAL . 10.0 p -74.03 52.57 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.898 0 CA-C-O 123.226 1.488 . . . . 0.0 114.839 -171.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -107.64 -34.14 7.09 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 173.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.54 144.79 25.43 Favored 'General case' 0 N--CA 1.424 -1.737 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 171.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . 0.257 7.2 p30 -76.34 -69.0 0.53 Allowed 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 -168.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . 0.258 0.0 OUTLIER -50.24 -73.16 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 117.479 2.4 . . . . 0.0 117.479 -164.911 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 58.8 tp -71.91 -31.98 66.94 Favored 'General case' 0 C--N 1.28 -2.453 0 CA-C-O 121.646 0.736 . . . . 0.0 111.236 -172.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . 0.585 ' HG2' ' O ' ' A' ' 529' ' ' TYR . 8.2 mpt_? -75.02 -44.0 50.48 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.34 -173.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -60.73 -40.21 91.5 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.481 ' O ' HD11 ' A' ' 542' ' ' LEU . 57.2 m -54.38 -49.14 70.56 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.908 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.17 -38.24 79.29 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 177.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 49.9 mm -68.29 -40.67 82.93 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 35.2 t -58.47 -45.46 88.61 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.696 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.481 HD11 ' O ' ' A' ' 538' ' ' THR . 6.8 mp -64.78 -30.08 71.07 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.959 177.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . 0.453 ' HA ' ' CD ' ' A' ' 478' ' ' LYS . 0.2 OUTLIER -76.29 -34.4 59.09 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 177.893 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -62.67 -36.11 81.83 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.374 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -67.67 113.39 5.42 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 172.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -134.52 103.08 5.54 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-O 121.962 0.887 . . . . 0.0 111.929 -178.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . 0.418 ' HG ' ' ND2' ' A' ' 554' ' ' ASN . 40.8 tp -91.85 -12.54 33.36 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.591 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -70.1 18.94 0.05 OUTLIER 'General case' 0 CA--C 1.559 1.31 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 -173.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -68.76 -31.39 70.39 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.65 0.738 . . . . 0.0 112.11 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.41 ' HB2' ' HD2' ' A' ' 551' ' ' PRO . 12.5 pt-20 -95.71 -178.97 0.84 Allowed Pre-proline 0 C--N 1.3 -1.582 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' A' ' 550' ' ' GLU . 83.9 Cg_exo -47.6 137.85 19.89 Favored 'Trans proline' 0 C--N 1.386 2.527 0 C-N-CA 121.811 1.674 . . . . 0.0 110.299 175.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -74.01 4.73 5.04 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 121.908 0.861 . . . . 0.0 112.866 -167.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . 0.417 ' HA ' HG12 ' A' ' 556' ' ' ILE . 1.9 mp0 -74.94 -12.6 60.39 Favored 'General case' 0 N--CA 1.408 -2.565 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.859 176.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . 0.418 ' ND2' ' HG ' ' A' ' 547' ' ' LEU . 28.0 p-10 -69.75 -24.4 63.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -80.34 -56.38 4.24 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -177.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . 0.434 ' O ' HG13 ' A' ' 560' ' ' VAL . 34.0 pt -64.69 -38.24 82.16 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.87 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . 0.406 ' HA ' HG13 ' A' ' 560' ' ' VAL . 36.2 t70 -63.94 -45.08 90.77 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -65.37 -45.78 82.73 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -56.22 -52.58 63.92 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 113.985 -1.461 . . . . 0.0 111.291 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . 0.434 HG13 ' O ' ' A' ' 556' ' ' ILE . 13.2 p -65.94 -36.01 76.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.353 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . 0.496 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 27.3 t-20 -62.55 -32.73 73.73 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.349 0.595 . . . . 0.0 110.232 176.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 70.2 t -77.35 -56.94 6.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 CA-C-N 115.553 -0.748 . . . . 0.0 112.522 175.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . . . . . . . . . 50.7 mm -74.77 -49.74 28.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.418 -169.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -80.78 -3.29 50.45 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.575 -174.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 29.4 tt0 -64.11 -32.75 74.43 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 168.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 64.7 mttm . . . . . 0 C--N 1.317 -0.838 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.046 174.754 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 82.1 mt . . . . . 0 N--CA 1.434 -1.238 0 CA-C-O 121.572 0.701 . . . . 0.0 110.529 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.7 m -106.12 -170.71 1.77 Allowed 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.187 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 471' ' ' LYS . 39.0 ttm180 -58.22 -24.17 58.29 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.199 1.0 . . . . 0.0 111.24 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.56 ' O ' ' HG3' ' A' ' 473' ' ' GLU . 20.9 mp0 -60.11 -24.84 64.98 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.813 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' A' ' 474' ' ' ARG . 8.3 tm-20 -66.48 -34.71 78.55 Favored 'General case' 0 C--O 1.206 -1.227 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 468' ' ' ARG . 13.3 tmtt? -66.36 -39.64 89.28 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.327 176.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -63.37 -49.3 74.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.839 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 469' ' ' GLN . 36.6 mt-10 -67.71 -34.55 77.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.853 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 470' ' ' GLU . 37.2 ttp180 -61.08 -45.55 94.26 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 123.987 0.915 . . . . 0.0 109.681 175.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . 0.41 ' HA ' HD21 ' A' ' 542' ' ' LEU . . . -68.3 -41.83 80.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.74 -179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -60.03 -51.06 71.25 Favored 'General case' 0 C--O 1.24 0.589 0 O-C-N 123.677 0.611 . . . . 0.0 110.27 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . 0.464 HD21 HG13 ' A' ' 507' ' ' VAL . 1.6 tt -57.8 -38.91 76.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.623 -1.171 . . . . 0.0 111.861 178.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 23.7 tptp -82.39 -13.94 56.01 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.714 -175.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -85.79 -53.86 4.87 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.325 -172.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.502 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 96.0 mt -101.71 107.69 18.99 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 121.766 0.793 . . . . 0.0 112.719 -173.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 53.1 mtt -94.74 -44.0 7.99 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.766 -174.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . 0.457 ' HG2' ' OE1' ' A' ' 520' ' ' GLN . 99.2 mtt180 -70.03 -31.14 68.64 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 122.378 1.085 . . . . 0.0 110.848 -179.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.502 ' HB2' ' HB3' ' A' ' 480' ' ' LEU . 4.7 m-20 -70.63 61.01 0.23 Allowed 'General case' 0 C--N 1.252 -3.653 0 C-N-CA 127.496 2.318 . . . . 0.0 116.83 -170.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . 0.571 ' HD3' ' OD2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -39.66 -41.51 1.07 Allowed 'General case' 0 N--CA 1.52 3.06 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 172.329 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -52.21 -52.93 49.32 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.053 0.941 . . . . 0.0 110.77 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.49 ' O ' ' HB3' ' A' ' 490' ' ' TYR . 68.0 m -64.14 -35.79 81.93 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.514 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -51.21 -54.07 29.13 Favored 'General case' 0 C--N 1.349 0.578 0 O-C-N 123.12 0.263 . . . . 0.0 110.634 177.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -78.54 -33.23 48.02 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 119.237 -0.985 . . . . 0.0 112.064 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.37 -32.83 74.02 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.176 0.512 . . . . 0.0 110.743 -176.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . 0.491 ' CE2' HG21 ' A' ' 494' ' ' VAL . 0.0 OUTLIER -86.59 -45.44 11.04 Favored 'General case' 0 N--CA 1.389 -3.513 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.954 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -56.12 -39.38 72.14 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -70.52 -25.15 62.99 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.505 0.669 . . . . 0.0 110.079 -176.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 23.1 m -90.01 -16.59 29.5 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 123.548 0.739 . . . . 0.0 112.641 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . 0.491 HG21 ' CE2' ' A' ' 490' ' ' TYR . 79.5 t -117.95 144.7 25.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -166.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . 0.479 ' OD2' ' HA ' ' A' ' 500' ' ' THR . 12.7 t70 71.49 -36.75 0.37 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 117.017 2.228 . . . . 0.0 117.017 167.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -41.8 -67.52 0.25 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -166.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . 0.264 8.6 m-20 -80.92 -73.22 0.38 Allowed 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 -175.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -101.41 -37.05 8.62 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -172.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -76.25 11.14 1.63 Allowed 'General case' 0 CA--C 1.56 1.351 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -173.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 500' ' ' THR . . . . . 0.479 ' HA ' ' OD2' ' A' ' 495' ' ' ASP . 25.7 m -53.68 105.74 0.15 Allowed 'General case' 0 C--O 1.249 1.059 0 C-N-CA 124.35 1.06 . . . . 0.0 113.639 -173.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -124.4 125.01 43.57 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 177.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -59.86 -9.04 2.53 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -171.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 8.8 t-80 -58.97 -49.54 77.49 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 172.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -63.95 -38.16 90.06 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.863 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -63.44 -50.24 70.53 Favored 'General case' 0 CA--C 1.501 -0.914 0 O-C-N 123.612 0.57 . . . . 0.0 109.63 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.434 ' O ' HG21 ' A' ' 510' ' ' VAL . 14.7 m-85 -56.61 -46.01 81.14 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.367 -178.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . 0.519 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 21.6 t -73.84 -46.37 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.541 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.844 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -51.72 -43.04 62.69 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 117.956 0.344 . . . . 0.0 111.647 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -57.09 -50.18 73.58 Favored 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 123.922 0.764 . . . . 0.0 109.135 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.434 HG21 ' O ' ' A' ' 506' ' ' TYR . 48.6 t -61.1 -51.12 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.666 175.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 95.5 mt -53.04 -51.03 63.06 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.763 -175.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -71.36 -32.7 68.81 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.977 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -66.74 -49.91 64.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.888 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . 0.282 1.0 OUTLIER -71.3 -26.53 62.9 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.28 177.312 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . 0.542 ' HA ' ' HB3' ' A' ' 519' ' ' ASP . 23.4 t80 -52.16 -41.17 62.37 Favored 'General case' 0 C--N 1.347 0.475 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 175.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -72.19 -15.06 61.95 Favored 'General case' 0 CA--C 1.555 1.153 0 CA-C-N 114.189 -1.368 . . . . 0.0 114.015 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -120.92 -57.25 1.89 Allowed 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -172.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -153.48 105.28 2.82 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 103.901 -2.629 . . . . 0.0 103.901 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . 0.571 ' OD2' ' HD3' ' A' ' 484' ' ' LYS . 8.0 p-10 -106.01 91.35 3.7 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 117.341 2.349 . . . . 0.0 117.341 -165.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . 0.457 ' OE1' ' HG2' ' A' ' 482' ' ' ARG . 25.2 mt-30 -145.06 158.45 43.81 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 126.707 2.003 . . . . 0.0 106.389 158.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -80.52 124.49 28.99 Favored 'General case' 0 N--CA 1.424 -1.747 0 CA-C-N 119.958 1.253 . . . . 0.0 108.668 176.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -107.68 148.31 29.55 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 42.2 pt -83.14 -14.98 11.75 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 122.951 0.5 . . . . 0.0 111.233 -175.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.607 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 42.4 p -57.16 -41.42 79.18 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.415 0.626 . . . . 0.0 109.501 176.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . 0.42 ' CG ' HG12 ' A' ' 510' ' ' VAL . 24.5 t70 -58.26 -49.62 76.47 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.17 177.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -59.83 -49.01 79.38 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.256 -178.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.616 ' O ' HG13 ' A' ' 530' ' ' VAL . 7.8 p -65.99 -29.29 46.37 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' A' ' 524' ' ' SER . 94.2 mt-30 -67.57 -43.5 80.44 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.751 0.786 . . . . 0.0 109.089 175.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -78.59 4.51 13.29 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.616 HG13 ' O ' ' A' ' 527' ' ' VAL . 8.8 p -83.02 -2.4 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.977 -176.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -105.06 -15.23 15.15 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.415 1.103 . . . . 0.0 108.544 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 532' ' ' SER . . . . . 0.479 ' C ' ' H ' ' A' ' 534' ' ' GLU . 37.0 t -95.99 -143.16 0.27 Allowed 'General case' 0 C--N 1.296 -1.754 0 C-N-CA 127.574 2.35 . . . . 0.0 108.821 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . 0.537 ' C ' ' H ' ' A' ' 535' ' ' LEU . 7.8 p30 -29.97 30.05 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.363 1 C-N-CA 137.252 6.221 . . . . 0.0 116.916 171.515 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . 0.479 ' H ' ' C ' ' A' ' 532' ' ' SER . 10.0 pt-20 -30.83 10.67 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.708 1 C-N-CA 133.034 4.534 . . . . 0.0 117.962 -173.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.537 ' H ' ' C ' ' A' ' 533' ' ' ASN . 4.3 mp -69.41 -23.92 63.78 Favored 'General case' 0 C--N 1.278 -2.514 0 N-CA-C 102.566 -3.124 . . . . 0.0 102.566 160.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . 0.452 ' O ' HG12 ' A' ' 540' ' ' ILE . 5.6 tpp180 -68.24 -29.44 68.25 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 112.214 -2.266 . . . . 0.0 110.274 171.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -71.77 -40.14 69.49 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 -178.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.433 ' O ' ' HB2' ' A' ' 541' ' ' SER . 24.4 m -58.69 -43.4 89.96 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 170.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 22.6 tp -59.72 -36.5 76.68 Favored 'General case' 0 CA--C 1.56 1.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.762 177.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 536' ' ' ARG . 35.3 mm -64.03 -37.96 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.506 0.722 . . . . 0.0 109.974 176.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 541' ' ' SER . . . . . 0.433 ' HB2' ' O ' ' A' ' 538' ' ' THR . 21.5 m -56.81 -39.11 73.55 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 121.122 0.487 . . . . 0.0 110.22 174.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.41 HD21 ' HA ' ' A' ' 475' ' ' ALA . 9.5 mp -66.51 -30.31 70.6 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.408 175.046 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -65.04 -45.13 86.7 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 175.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -75.59 45.99 0.34 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.195 174.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -50.86 136.57 22.22 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 125.024 1.33 . . . . 0.0 110.084 -177.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . 0.467 ' C ' ' H ' ' A' ' 548' ' ' ASN . 12.2 t30 -83.75 179.67 7.53 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.942 -172.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . 0.506 ' C ' ' H ' ' A' ' 549' ' ' ASP . 3.1 mm? -70.01 23.63 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.317 1.847 . . . . 0.0 113.851 -174.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . 0.467 ' H ' ' C ' ' A' ' 546' ' ' ASN . 17.4 m120 -75.45 24.75 0.11 Allowed 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 127.095 2.158 . . . . 0.0 110.208 174.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . 0.506 ' H ' ' C ' ' A' ' 547' ' ' LEU . 11.0 m-20 -58.88 32.72 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 127.97 2.508 . . . . 0.0 117.493 -172.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -74.68 160.05 81.86 Favored Pre-proline 0 C--N 1.3 -1.563 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -37.4 130.36 0.66 Allowed 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 123.562 2.841 . . . . 0.0 111.233 178.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 31.3 p90 -73.37 -6.98 49.68 Favored 'General case' 0 CA--C 1.495 -1.155 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -167.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 59.0 mp0 -71.36 -1.08 11.73 Favored 'General case' 0 C--N 1.291 -1.944 0 C-N-CA 124.256 1.023 . . . . 0.0 111.527 174.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -62.73 -21.57 65.9 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 123.827 0.851 . . . . 0.0 108.887 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -48.27 -62.96 1.22 Allowed 'General case' 0 C--O 1.215 -0.763 0 C-N-CA 124.58 1.152 . . . . 0.0 113.93 -177.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 16.8 mt -66.39 -36.78 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-O 120.87 0.367 . . . . 0.0 110.14 -174.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -56.98 -52.02 66.89 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.787 177.417 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . 0.447 ' O ' HG22 ' A' ' 562' ' ' VAL . 32.8 t70 -66.94 -49.97 63.82 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.278 178.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -49.75 -53.57 24.18 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.17 1.788 . . . . 0.0 111.655 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 65.4 t -63.21 -47.93 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.625 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -60.14 -41.61 93.07 Favored 'General case' 0 C--O 1.201 -1.458 0 O-C-N 123.069 0.231 . . . . 0.0 111.275 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . 0.447 HG22 ' O ' ' A' ' 558' ' ' ASP . 69.9 t -62.74 -37.3 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-O 121.403 0.62 . . . . 0.0 111.708 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.442 ' HA ' ' CG ' ' A' ' 469' ' ' GLN . 54.6 mt -87.24 -39.8 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.916 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.306 -173.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -81.93 -14.98 55.34 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.01 -174.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -71.95 -13.06 61.53 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.47 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . 0.529 ' HB2' ' NE2' ' A' ' 469' ' ' GLN . 63.0 tttm . . . . . 0 N--CA 1.466 0.36 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.612 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.6 mm? . . . . . 0 N--CA 1.412 -2.327 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.8 m -57.04 107.37 0.4 Allowed 'General case' 0 C--N 1.289 -2.036 0 O-C-N 124.278 0.986 . . . . 0.0 113.012 -174.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 4.9 ptm85 -65.2 -22.89 66.95 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 177.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.669 ' NE2' ' HB3' ' A' ' 566' ' ' LYS . 97.4 mt-30 -66.3 -32.15 73.38 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 174.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.633 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 3.2 tm-20 -71.24 -28.47 64.2 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -66.69 -35.42 80.1 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.513 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.47 99.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.157 0.504 . . . . 0.0 109.72 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . 0.485 ' CD ' ' HZ1' ' A' ' 496' ' ' LYS . 34.6 mt-10 -66.35 -35.6 80.75 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.92 177.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.633 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 90.8 mtt180 -57.24 -43.29 82.78 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 175.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . 0.471 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -66.19 -48.36 70.93 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.477 178.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.94 -8.31 6.91 Favored 'General case' 0 C--O 1.25 1.129 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 178.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . 0.687 ' O ' ' HG ' ' A' ' 480' ' ' LEU . 1.0 OUTLIER -55.83 -27.87 53.52 Favored 'General case' 0 C--O 1.21 -1.025 0 O-C-N 122.053 -0.404 . . . . 0.0 111.314 174.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 47.8 pttt -56.83 -7.96 0.53 Allowed 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 124.486 1.114 . . . . 0.0 112.495 176.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . 0.552 ' CD2' ' HA ' ' A' ' 487' ' ' PHE . 24.1 p-80 -52.95 -31.24 39.38 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.312 1.045 . . . . 0.0 110.335 177.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.687 ' HG ' ' O ' ' A' ' 477' ' ' LEU . 1.9 pp -71.99 5.75 2.5 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.524 1.129 . . . . 0.0 113.221 -173.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 92.8 mmm -94.38 -27.57 15.99 Favored 'General case' 0 N--CA 1.42 -1.954 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.014 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . 0.58 ' HB3' ' OG1' ' A' ' 486' ' ' THR . 40.0 ttt180 -78.18 -98.57 0.02 OUTLIER 'General case' 0 C--N 1.367 1.338 0 C-N-CA 117.79 -1.564 . . . . 0.0 109.71 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -145.35 -94.65 0.1 Allowed 'General case' 0 C--N 1.385 2.14 0 C-N-CA 113.462 -3.295 . . . . 0.0 117.752 161.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -101.2 -43.75 5.89 Favored 'General case' 0 CA--C 1.482 -1.664 0 CA-C-O 122.718 1.247 . . . . 0.0 112.183 174.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 489' ' ' ASN . 5.8 p-10 -54.16 -43.19 70.41 Favored 'General case' 0 CA--C 1.483 -1.602 0 CA-C-N 112.507 -2.133 . . . . 0.0 109.911 -175.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.58 ' OG1' ' HB3' ' A' ' 482' ' ' ARG . 2.7 m -67.4 -35.34 79.1 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.336 -174.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . 0.552 ' HA ' ' CD2' ' A' ' 479' ' ' HIS . 49.1 t80 -62.59 -55.67 25.02 Favored 'General case' 0 CA--C 1.496 -1.113 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.897 178.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 2.0 tp -75.63 -22.98 56.34 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.809 -176.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 485' ' ' ASP . 5.4 t30 -63.23 -47.01 84.27 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -176.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.33 -32.8 24.1 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.163 -1.015 . . . . 0.0 111.53 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -69.93 -38.02 76.09 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 123.408 0.683 . . . . 0.0 112.16 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -79.93 -30.16 39.88 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 120.906 0.384 . . . . 0.0 110.981 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 36.5 m -77.99 -40.41 39.23 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.577 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . 0.46 HG21 ' HH ' ' A' ' 559' ' ' TYR . 58.8 t -99.72 100.02 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 CA-C-O 121.859 0.838 . . . . 0.0 109.436 -177.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -87.09 21.06 2.45 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.556 -176.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.485 ' HZ1' ' CD ' ' A' ' 473' ' ' GLU . 1.5 ttpm? -90.13 18.02 6.36 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -64.03 -20.44 65.92 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 124.79 1.236 . . . . 0.0 113.953 -171.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -82.33 -21.49 35.99 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.32 0.581 . . . . 0.0 110.492 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -79.79 -25.45 40.91 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.08 -179.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 3.3 m -67.3 140.03 57.29 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.91 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.03 175.75 2.99 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 124.841 1.256 . . . . 0.0 112.54 -176.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . 0.457 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -57.42 -19.69 25.22 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.626 1.17 . . . . 0.0 112.261 -178.211 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . 0.449 ' O ' HG22 ' A' ' 507' ' ' VAL . 17.1 t-160 -55.97 -40.01 72.64 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 125.146 1.378 . . . . 0.0 109.228 177.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . 0.561 ' O ' ' HD1' ' A' ' 508' ' ' PHE . 55.3 t80 -57.74 -53.16 61.31 Favored 'General case' 0 C--O 1.203 -1.365 0 C-N-CA 125.572 1.549 . . . . 0.0 108.619 177.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.457 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 72.5 tttt -57.93 -43.3 86.18 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 125.771 1.629 . . . . 0.0 111.923 -173.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -61.49 -56.11 23.72 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.49 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . 0.564 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 3.2 t -67.48 -46.99 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.705 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.808 -174.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . 0.561 ' HD1' ' O ' ' A' ' 504' ' ' PHE . 59.2 m-85 -55.3 -34.6 64.29 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 178.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -60.76 -52.43 65.14 Favored 'General case' 0 C--O 1.256 1.41 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 176.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 17.9 t -63.29 -46.26 96.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.898 177.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 93.5 mt -59.76 -49.28 78.34 Favored 'General case' 0 C--O 1.206 -1.198 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.545 -176.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -66.36 -28.7 68.85 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.737 0.303 . . . . 0.0 110.352 -177.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -70.44 -27.75 64.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.194 0.521 . . . . 0.0 110.249 177.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -83.07 -42.42 17.46 Favored 'General case' 0 CA--C 1.481 -1.677 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 175.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -50.24 -24.91 3.17 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.663 1.185 . . . . 0.0 111.349 176.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -52.71 -35.63 56.01 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 173.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -108.81 -61.32 1.63 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 119.62 -0.832 . . . . 0.0 109.482 173.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -159.14 135.71 9.3 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -75.84 97.01 3.8 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 120.47 1.486 . . . . 0.0 108.756 177.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -137.51 94.88 2.98 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.43 -176.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . 0.466 ' CG ' HD23 ' A' ' 480' ' ' LEU . 0.1 OUTLIER -58.45 143.63 44.82 Favored 'General case' 0 N--CA 1.401 -2.896 0 CA-C-O 121.604 0.716 . . . . 0.0 112.101 173.715 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -118.45 135.02 54.61 Favored 'General case' 0 C--N 1.285 -2.234 0 N-CA-C 105.14 -2.171 . . . . 0.0 105.14 173.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . 0.428 ' O ' HG11 ' A' ' 527' ' ' VAL . 3.9 tp -53.68 -34.47 24.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 O-C-N 123.659 0.599 . . . . 0.0 112.032 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 28.9 t -55.36 -48.86 73.61 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 122.977 0.511 . . . . 0.0 111.01 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.04 -42.85 99.61 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.89 0.852 . . . . 0.0 110.255 178.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . 0.418 ' HB2' ' CE2' ' A' ' 521' ' ' TYR . . . -58.74 -52.99 63.33 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.788 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.428 HG11 ' O ' ' A' ' 523' ' ' ILE . 14.1 p -70.36 -36.23 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.924 0 C-N-CA 123.366 0.666 . . . . 0.0 111.998 -177.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -71.67 -12.95 61.59 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 121.074 -1.016 . . . . 0.0 110.651 177.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.495 ' HB3' ' HG3' ' A' ' 536' ' ' ARG . 0.0 OUTLIER -76.52 -3.91 39.89 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.991 173.229 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . . . . . . . . . 4.7 p -72.88 22.57 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.573 1.83 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -176.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -70.41 -34.96 73.12 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 121.186 -0.946 . . . . 0.0 108.635 174.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 23.1 t -91.42 111.04 22.37 Favored 'General case' 0 N--CA 1.42 -1.939 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 170.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -61.4 -60.98 2.88 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.098 -174.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -56.31 -46.58 79.78 Favored 'General case' 0 C--O 1.244 0.794 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.62 -174.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.59 -56.5 9.18 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.002 -173.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . 0.495 ' HG3' ' HB3' ' A' ' 529' ' ' TYR . 2.3 mmt180 -72.4 -28.24 62.86 Favored 'General case' 0 N--CA 1.419 -2.018 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.45 -52.44 65.36 Favored 'General case' 0 C--O 1.251 1.174 0 CA-C-N 119.261 0.937 . . . . 0.0 110.002 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.432 ' O ' ' HB2' ' A' ' 541' ' ' SER . 1.9 p -63.93 -46.08 86.36 Favored 'General case' 0 N--CA 1.425 -1.689 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.284 177.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 19.0 tp -62.82 -32.89 74.18 Favored 'General case' 0 CA--C 1.56 1.341 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 536' ' ' ARG . 55.9 mt -66.94 -38.42 81.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 173.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 541' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 538' ' ' THR . 50.0 m -57.28 -38.54 74.08 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.047 172.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.606 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 3.9 mm? -71.78 -27.3 62.85 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 173.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -61.83 -56.09 23.11 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 174.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 540' ' ' ILE . 28.1 pt20 -80.21 13.25 2.42 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.665 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . 0.606 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 2.9 t80 -66.26 118.33 9.81 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.655 0.741 . . . . 0.0 110.93 177.524 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -94.03 120.62 34.54 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.714 -175.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.15 7.15 16.89 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -177.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -81.93 -21.13 37.46 Favored 'General case' 0 C--N 1.312 -1.049 0 O-C-N 121.304 -0.873 . . . . 0.0 109.799 175.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -69.31 -67.55 0.47 Allowed 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -86.5 111.65 40.9 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 167.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -50.1 146.61 17.13 Favored 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 123.464 2.776 . . . . 0.0 114.579 -170.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -73.97 -2.92 26.12 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 122.145 0.974 . . . . 0.0 111.043 -173.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -81.97 -41.59 20.56 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.518 170.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -73.07 -22.05 60.67 Favored 'General case' 0 C--O 1.185 -2.316 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -24.71 -70.3 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 126.629 1.972 . . . . 0.0 113.428 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 53.2 mt -68.46 -47.88 75.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.82 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -59.29 -48.89 79.92 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.097 -0.956 . . . . 0.0 113.026 -175.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -66.46 -51.39 57.31 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 124.084 0.953 . . . . 0.0 110.638 -177.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.46 ' HH ' HG21 ' A' ' 494' ' ' VAL . 40.6 t80 -51.58 -52.13 49.88 Favored 'General case' 0 C--O 1.246 0.872 0 C-N-CA 124.157 0.983 . . . . 0.0 110.474 176.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 95.0 t -66.91 -40.16 85.12 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.738 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -58.73 -39.4 80.77 Favored 'General case' 0 C--O 1.196 -1.757 0 C-N-CA 122.993 0.517 . . . . 0.0 110.637 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 47.2 t -66.32 -36.59 77.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.418 0.628 . . . . 0.0 111.873 177.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.497 ' HA ' ' HG2' ' A' ' 469' ' ' GLN . 49.6 mt -78.67 -43.93 25.68 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 CA-C-O 121.738 0.78 . . . . 0.0 109.678 -177.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -77.94 -6.55 54.75 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.152 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.419 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 29.2 tt0 -61.74 -45.58 93.31 Favored 'General case' 0 CA--C 1.49 -1.346 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 175.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . 0.669 ' HB3' ' NE2' ' A' ' 469' ' ' GLN . 59.4 tttm . . . . . 0 C--N 1.303 -1.449 0 CA-C-O 122.554 1.168 . . . . 0.0 108.129 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 98.9 mt . . . . . 0 N--CA 1.437 -1.09 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 17.0 m -58.9 136.72 57.95 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 114.021 -1.445 . . . . 0.0 114.298 -171.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -65.83 -32.78 74.5 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.911 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.456 ' HG2' ' HA ' ' A' ' 563' ' ' ILE . 97.3 mt-30 -64.28 -41.85 96.69 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 175.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 5.8 tm-20 -63.34 -29.05 70.42 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.287 178.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 25.9 mmtm -66.34 -37.86 86.32 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.555 171.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.44 -36.96 71.44 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.118 -177.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 504' ' ' PHE . 0.9 OUTLIER -57.94 -40.81 81.4 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 123.327 0.392 . . . . 0.0 110.777 171.863 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 93.4 mtt180 -62.37 -42.81 99.7 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 177.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -67.44 -29.88 69.47 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.058 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -66.03 -33.58 76.12 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.68 0.752 . . . . 0.0 109.875 177.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 87.3 mt -76.52 10.57 2.03 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.446 177.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.433 ' HE3' ' CD2' ' A' ' 545' ' ' TYR . 18.9 tptm -59.88 -10.62 4.18 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.433 1.093 . . . . 0.0 112.989 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -74.76 142.03 44.35 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.908 -0.495 . . . . 0.0 111.424 -176.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.527 HD12 ' H ' ' A' ' 480' ' ' LEU . 0.0 OUTLIER -75.66 -150.77 0.03 OUTLIER 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.792 175.252 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' MET . . . . . 0.469 ' C ' ' H ' ' A' ' 483' ' ' ASP . 66.8 mtt -50.4 -9.88 0.05 Allowed 'General case' 0 N--CA 1.516 2.851 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 -177.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -72.92 7.12 2.18 Favored 'General case' 0 CA--C 1.561 1.386 0 C-N-CA 125.185 1.394 . . . . 0.0 109.518 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.469 ' H ' ' C ' ' A' ' 481' ' ' MET . 5.5 p-10 -70.41 -10.96 60.52 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 125.701 1.6 . . . . 0.0 113.65 -170.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -63.02 -44.63 95.44 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.738 0.78 . . . . 0.0 109.649 176.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.61 -51.67 66.38 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 114.726 -1.124 . . . . 0.0 109.649 178.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 59.0 m -61.81 -40.64 95.95 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 114.561 -1.199 . . . . 0.0 111.995 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . 0.528 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 23.1 t80 -56.57 -53.28 59.4 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 122.394 0.278 . . . . 0.0 110.734 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . 0.436 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 65.8 mt -72.73 -25.46 61.22 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.588 -178.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -69.23 -39.85 78.28 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.636 0.731 . . . . 0.0 110.085 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.79 -21.48 26.47 Favored 'General case' 0 N--CA 1.424 -1.737 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.326 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . 0.528 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.3 OUTLIER -67.03 -41.24 86.94 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 123.801 0.84 . . . . 0.0 109.332 178.878 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 8.9 pt-20 -77.92 -46.32 21.6 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -176.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 27.5 p -89.98 -28.65 18.98 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -170.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 47.0 t -91.2 162.7 2.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 O-C-N 122.012 -0.43 . . . . 0.0 111.187 -170.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -75.09 109.82 8.88 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 121.896 0.855 . . . . 0.0 111.05 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -88.9 -25.02 22.34 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.143 -1.389 . . . . 0.0 108.715 176.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -86.75 -66.57 0.89 Allowed 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 118.845 2.906 . . . . 0.0 118.845 -166.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -107.27 -34.15 7.19 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 118.723 2.86 . . . . 0.0 118.723 -160.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -76.77 -94.97 0.02 OUTLIER 'General case' 0 CA--C 1.566 1.574 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -163.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 19.6 m -129.84 76.08 1.7 Allowed 'General case' 0 C--N 1.314 -0.977 0 O-C-N 120.794 -1.191 . . . . 0.0 109.303 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -130.79 45.87 2.75 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 117.397 2.369 . . . . 0.0 117.397 -170.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -84.85 -33.65 22.8 Favored 'General case' 0 CA--C 1.492 -1.278 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 170.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . 0.536 ' CD2' HD12 ' A' ' 535' ' ' LEU . 45.4 m170 -59.25 -51.68 68.94 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . 0.434 ' CZ ' ' HB3' ' A' ' 473' ' ' GLU . 97.0 m-85 -68.01 -25.76 65.55 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 113.973 -1.467 . . . . 0.0 114.308 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -63.83 -46.83 83.32 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 175.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.572 ' O ' HG22 ' A' ' 510' ' ' VAL . 2.6 t80 -64.37 -32.56 74.23 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.893 -1.049 . . . . 0.0 112.379 174.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.53 -50.4 72.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 173.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -51.98 -43.01 63.38 Favored 'General case' 0 C--N 1.355 0.845 0 CA-C-O 120.899 0.38 . . . . 0.0 110.126 173.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -55.98 -60.11 3.95 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.341 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 506' ' ' TYR . 21.5 t -58.07 -53.58 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 O-C-N 123.57 0.544 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.58 -36.94 85.25 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -174.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -70.06 -32.2 70.18 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.485 -0.486 . . . . 0.0 109.808 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -72.43 -27.69 62.49 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 178.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -67.04 -54.24 23.49 Favored 'General case' 0 CA--C 1.49 -1.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.907 171.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -49.96 -29.68 8.95 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.801 0.84 . . . . 0.0 112.552 178.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -63.77 -36.23 83.21 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.572 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -111.89 -59.41 1.99 Allowed 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.4 -176.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -157.31 118.81 3.69 Favored 'General case' 0 CA--C 1.493 -1.224 0 C-N-CA 125.148 1.379 . . . . 0.0 107.659 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -90.95 92.51 8.79 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -175.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -144.4 128.93 18.05 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 126.49 1.916 . . . . 0.0 107.055 162.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -70.32 132.42 45.65 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 119.546 1.066 . . . . 0.0 110.453 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -118.73 135.0 54.73 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 34.5 pt -79.47 -16.21 13.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 122.152 0.977 . . . . 0.0 110.216 -175.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 5.6 p -60.05 -30.9 69.5 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.258 172.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.73 -39.64 91.34 Favored 'General case' 0 CA--C 1.481 -1.675 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.771 178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.3 99.59 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.325 -0.95 . . . . 0.0 109.34 175.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.507 ' O ' HG12 ' A' ' 530' ' ' VAL . 61.5 t -61.8 -35.92 70.65 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.375 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.966 175.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -72.24 -24.24 61.34 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 121.498 -0.751 . . . . 0.0 111.332 176.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -79.64 -23.08 42.82 Favored 'General case' 0 N--CA 1.44 -0.97 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 175.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.507 HG12 ' O ' ' A' ' 527' ' ' VAL 0.369 12.2 p -75.93 55.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.241 0.606 0 CA-C-O 123.062 1.41 . . . . 0.0 114.034 -177.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -105.0 -29.95 10.1 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 104.209 -2.515 . . . . 0.0 104.209 172.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 46.5 m -92.92 161.9 14.29 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 164.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -86.29 -58.43 2.63 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 -176.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.17 -79.64 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 -161.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.536 HD12 ' CD2' ' A' ' 503' ' ' HIS . 2.6 mm? -75.44 -17.27 60.2 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 122.109 0.956 . . . . 0.0 112.132 -172.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -77.84 -46.0 22.72 Favored 'General case' 0 C--N 1.272 -2.799 0 CA-C-N 113.775 -1.557 . . . . 0.0 107.523 -173.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -66.5 -38.32 86.98 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.086 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 32.1 m -57.07 -51.61 68.6 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.709 178.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 27.9 tp -57.7 -45.55 85.52 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 111.323 0.12 . . . . 0.0 111.323 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 78.9 mt -60.18 -37.79 74.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-O 121.424 0.631 . . . . 0.0 110.289 176.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.7 m -57.27 -35.41 69.73 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.474 176.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.31 -43.89 69.41 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.903 0.382 . . . . 0.0 110.218 174.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . 0.427 ' C ' ' H ' ' A' ' 545' ' ' TYR . 83.1 mt-10 -60.9 -36.43 79.23 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.09 0.956 . . . . 0.0 113.084 -177.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -72.48 23.81 0.06 Allowed 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . 0.433 ' CD2' ' HE3' ' A' ' 478' ' ' LYS . 50.7 t80 -65.92 147.16 53.8 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -87.59 173.67 8.91 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -173.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . 0.451 ' C ' ' H ' ' A' ' 549' ' ' ASP . 7.7 mp -80.53 21.42 0.64 Allowed 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -174.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 23.2 p-10 -77.02 22.78 0.19 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.197 0.599 . . . . 0.0 111.98 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . 0.451 ' H ' ' C ' ' A' ' 547' ' ' LEU . 23.0 m-20 -63.67 3.84 0.32 Allowed 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 127.148 2.179 . . . . 0.0 115.181 -175.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.428 ' HB3' ' HD2' ' A' ' 551' ' ' PRO . 47.0 mt-10 -60.26 151.57 67.19 Favored Pre-proline 0 C--N 1.308 -1.199 0 CA-C-O 118.789 -0.624 . . . . 0.0 109.74 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . 0.428 ' HD2' ' HB3' ' A' ' 550' ' ' GLU . 1.9 Cg_exo 8.99 74.71 0.0 OUTLIER 'Trans proline' 0 C--N 1.379 2.179 1 C-N-CA 126.534 4.823 . . . . 0.0 117.032 -164.339 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 56.0 p90 -84.56 5.0 29.46 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.574 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -73.5 10.4 1.06 Allowed 'General case' 0 C--N 1.288 -2.102 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -176.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -76.04 -21.66 56.56 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 168.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -25.41 -75.38 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 127.322 2.249 . . . . 0.0 113.348 178.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 22.4 pt -61.99 -35.73 70.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 C-N-CA 123.85 0.86 . . . . 0.0 112.432 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.34 -54.11 47.96 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -63.43 -46.34 86.76 Favored 'General case' 0 C--O 1.201 -1.496 0 CA-C-N 113.897 -1.501 . . . . 0.0 110.909 -179.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.578 ' O ' HG12 ' A' ' 563' ' ' ILE . 75.5 t80 -57.77 -53.3 59.72 Favored 'General case' 0 C--N 1.291 -1.94 0 C-N-CA 123.798 0.839 . . . . 0.0 112.009 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 71.6 t -63.55 -46.63 94.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . 0.462 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 64.4 m-20 -60.32 -47.7 84.9 Favored 'General case' 0 C--O 1.175 -2.842 0 CA-C-O 118.151 -0.928 . . . . 0.0 112.149 177.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . 0.446 ' HA ' ' HG2' ' A' ' 565' ' ' GLU . 55.6 t -60.38 -47.87 90.66 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.991 0 CA-C-N 119.271 0.941 . . . . 0.0 111.289 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.578 HG12 ' O ' ' A' ' 559' ' ' TYR . 38.5 mm -66.03 -32.41 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-O 121.543 0.687 . . . . 0.0 110.321 -176.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -92.29 -22.76 19.56 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -175.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 561' ' ' ASN . 6.9 pt-20 -85.24 -28.69 25.2 Favored 'General case' 0 CA--C 1.505 -0.76 0 C-N-CA 119.473 -0.891 . . . . 0.0 109.039 -175.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.829 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.942 -175.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 73.9 mt . . . . . 0 N--CA 1.427 -1.614 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 49.6 m -98.67 105.63 17.8 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -167.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -68.09 -40.13 82.72 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 114.504 -1.225 . . . . 0.0 107.95 171.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -59.0 -32.14 69.42 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 113.517 -1.674 . . . . 0.0 110.856 -178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.601 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 38.0 tt0 -67.16 -34.97 78.69 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.211 178.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 471' ' ' LYS . 2.2 tmtp? -66.66 -41.6 87.95 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -178.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -60.06 -41.29 92.05 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.987 177.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . 0.525 ' HB3' ' CZ ' ' A' ' 504' ' ' PHE . 0.3 OUTLIER -66.21 -39.41 89.61 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.386 179.629 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.601 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 98.2 mtt180 -55.08 -45.08 75.37 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.152 0.501 . . . . 0.0 109.83 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -68.14 -42.55 79.94 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.03 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -63.02 -52.81 61.45 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.799 -177.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.79 -40.42 92.53 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 124.007 0.817 . . . . 0.0 109.865 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 19.5 tttp -49.17 -70.69 0.08 Allowed 'General case' 0 C--O 1.221 -0.425 0 O-C-N 123.888 0.742 . . . . 0.0 111.994 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . 0.26 16.6 m170 27.97 -100.92 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 115.324 1.602 . . . . 0.0 115.324 -174.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 78.9 mt -166.46 179.95 5.27 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 126.084 1.754 . . . . 0.0 106.762 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 1.4 pmm? -75.93 -8.41 56.85 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.783 0.802 . . . . 0.0 110.293 178.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -63.08 -47.24 83.73 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 124.76 1.224 . . . . 0.0 110.392 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.442 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 3.3 m-20 -71.34 43.71 0.08 Allowed 'General case' 0 C--N 1.285 -2.203 0 C-N-CA 126.647 1.979 . . . . 0.0 115.78 -172.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -67.57 -39.77 84.91 Favored 'General case' 0 C--O 1.247 0.929 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.21 -52.53 65.17 Favored 'General case' 0 C--O 1.205 -1.282 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.242 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.442 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 3.4 m -56.92 -42.73 80.51 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 124.661 1.184 . . . . 0.0 111.22 -177.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . 0.466 ' CE1' ' HE2' ' A' ' 491' ' ' TYR . 84.0 t80 -51.3 -56.61 12.11 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.637 0.775 . . . . 0.0 109.719 175.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 63.7 mt -74.81 -28.3 60.66 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 122.085 -0.384 . . . . 0.0 111.341 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -69.81 -27.12 64.62 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.288 0.566 . . . . 0.0 110.859 -177.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.22 -40.31 19.79 Favored 'General case' 0 N--CA 1.414 -2.233 0 C-N-CA 120.084 -0.646 . . . . 0.0 109.318 177.28 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . 0.466 ' HE2' ' CE1' ' A' ' 487' ' ' PHE . 42.1 m-85 -58.01 -32.64 68.13 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -77.71 -38.85 46.41 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.607 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 17.8 t -87.23 -39.28 15.58 Favored 'General case' 0 C--O 1.249 1.074 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -173.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 41.9 t -92.97 166.66 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 -175.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -80.27 117.39 21.0 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -67.96 -44.37 76.87 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.078 -176.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.07 -53.86 47.03 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 -169.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -76.69 -35.0 58.17 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.176 -174.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . 0.432 ' CZ ' HG22 ' A' ' 563' ' ' ILE 0.262 37.2 m-85 -78.6 -15.25 58.75 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -178.357 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 57.4 m -77.04 86.91 3.54 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 118.737 -1.185 . . . . 0.0 108.379 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -84.45 -178.2 6.84 Favored 'General case' 0 C--O 1.208 -1.112 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -63.15 -35.38 80.1 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -59.31 -56.92 15.9 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.565 -1.652 . . . . 0.0 108.422 177.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . 0.525 ' CZ ' ' HB3' ' A' ' 473' ' ' GLU 0.309 57.6 m-85 -66.73 -26.83 67.19 Favored 'General case' 0 N--CA 1.421 -1.88 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 178.865 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 36.1 tttm -63.0 -47.6 82.41 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 175.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.565 ' O ' HG22 ' A' ' 510' ' ' VAL . 9.2 m-85 -52.51 -60.7 2.92 Favored 'General case' 0 N--CA 1.439 -1.022 0 O-C-N 124.506 1.129 . . . . 0.0 110.937 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . 0.406 HG23 ' HA ' ' A' ' 504' ' ' PHE . 22.7 m -65.45 -44.81 94.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -50.49 -51.83 43.7 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.094 0.557 . . . . 0.0 110.604 176.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -57.74 -51.93 67.52 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.541 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 506' ' ' TYR . 21.8 t -62.42 -47.6 92.26 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 O-C-N 123.475 0.484 . . . . 0.0 111.764 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 3.8 tt -68.2 -41.33 81.53 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.859 -174.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -66.53 -41.98 87.94 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.376 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -64.23 -49.33 72.36 Favored 'General case' 0 CA--C 1.501 -0.907 0 C-N-CA 123.272 0.629 . . . . 0.0 110.763 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -61.63 -46.96 87.54 Favored 'General case' 0 C--O 1.177 -2.738 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.946 177.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 0.5 OUTLIER -48.29 -39.94 23.32 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.761 0.824 . . . . 0.0 110.0 -179.323 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.15 -56.52 5.92 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.467 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -95.48 -11.06 28.14 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -169.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -150.96 -151.29 0.38 Allowed 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 106.449 -1.686 . . . . 0.0 106.449 -175.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -97.38 -162.95 1.0 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 176.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -83.77 -170.69 3.2 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 118.431 0.56 . . . . 0.0 112.299 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -41.69 118.78 1.15 Allowed 'General case' 0 N--CA 1.418 -2.069 0 N-CA-C 115.559 1.689 . . . . 0.0 115.559 -178.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -107.27 111.55 23.98 Favored 'General case' 0 N--CA 1.415 -2.194 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 172.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 30.7 pt -54.78 -28.04 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.098 1.359 . . . . 0.0 112.901 -174.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 10.2 m -58.51 -31.52 67.96 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.563 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -36.65 77.91 Favored 'General case' 0 C--O 1.245 0.852 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . 0.622 ' HA ' ' CD2' ' A' ' 529' ' ' TYR . . . -61.52 -35.6 78.18 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.04 178.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 52.3 t -67.91 -34.86 69.71 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.496 0 C-N-CA 124.381 1.072 . . . . 0.0 108.996 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -66.44 -20.74 66.13 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.622 ' CD2' ' HA ' ' A' ' 526' ' ' ALA . 18.9 m-85 -74.65 7.14 3.22 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.172 173.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.446 ' HA ' ' CB ' ' A' ' 536' ' ' ARG . 8.1 p -72.9 14.25 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.625 0 CA-C-O 122.334 1.064 . . . . 0.0 110.411 173.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . 0.47 ' H ' ' C ' ' A' ' 529' ' ' TYR . 46.3 m-80 -101.35 -21.18 14.91 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 532' ' ' SER . . . . . 0.542 ' OG ' ' HB2' ' A' ' 535' ' ' LEU . 80.9 p -83.91 157.89 21.79 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -63.5 -61.92 2.01 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -94.23 -40.5 9.97 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -173.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.542 ' HB2' ' OG ' ' A' ' 532' ' ' SER . 99.5 mt -62.99 -22.66 67.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -174.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . 0.446 ' CB ' ' HA ' ' A' ' 530' ' ' VAL . 18.0 ptp180 -59.61 -42.84 93.54 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.428 0.632 . . . . 0.0 109.567 177.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -70.53 -56.53 6.33 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.274 -177.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.459 ' O ' HD13 ' A' ' 542' ' ' LEU . 12.9 m -59.12 -53.65 55.92 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.375 -176.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' A' ' 526' ' ' ALA 0.262 4.4 mm? -61.72 -38.91 89.63 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.232 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . 0.574 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 69.4 mt -69.04 -36.77 75.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.052 176.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 57.5 m -56.17 -43.52 78.46 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.524 0.678 . . . . 0.0 109.617 173.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 538' ' ' THR . 8.8 mp -65.63 -31.23 72.15 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.114 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -70.9 -41.42 71.3 Favored 'General case' 0 C--N 1.317 -0.844 0 O-C-N 122.086 -0.384 . . . . 0.0 110.772 177.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . 0.574 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 76.5 mt-30 -69.9 -27.87 65.15 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.195 -177.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -67.48 118.59 11.02 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 174.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -124.7 130.67 52.85 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -168.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 61.9 tp -75.24 -27.89 59.66 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.956 -178.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -73.17 -36.81 66.67 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.806 -0.357 . . . . 0.0 111.058 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -68.73 -55.25 11.96 Favored 'General case' 0 CA--C 1.508 -0.673 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.382 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.53 114.5 25.26 Favored Pre-proline 0 C--N 1.298 -1.654 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.74 151.74 74.49 Favored 'Trans proline' 0 C--O 1.249 1.041 0 C-N-CA 122.585 2.19 . . . . 0.0 111.333 175.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -126.89 49.86 2.02 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.824 0.821 . . . . 0.0 111.307 -174.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.96 -12.63 60.0 Favored 'General case' 0 C--N 1.285 -2.23 0 CA-C-O 121.667 0.746 . . . . 0.0 112.314 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -79.29 -22.29 44.84 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 124.489 1.116 . . . . 0.0 108.789 173.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -39.07 -69.36 0.13 Allowed 'General case' 0 C--O 1.199 -1.56 0 C-N-CA 125.331 1.453 . . . . 0.0 111.585 -175.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 38.8 pt -54.1 -39.68 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 123.724 0.64 . . . . 0.0 112.193 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.35 -55.01 36.47 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.951 0.9 . . . . 0.0 110.995 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -73.96 -35.89 64.56 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.326 -175.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.612 ' CE1' HD13 ' A' ' 563' ' ' ILE . 93.4 t80 -57.25 -52.74 64.11 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 125.164 1.386 . . . . 0.0 111.648 177.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 14.4 p -64.21 -38.37 82.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 109.811 -0.441 . . . . 0.0 109.811 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 27.1 t-20 -61.76 -45.41 94.02 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.476 178.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.54 -50.47 34.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -178.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.612 HD13 ' CE1' ' A' ' 559' ' ' TYR . 30.5 mt -95.85 -45.74 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.118 0 CA-C-O 121.793 0.806 . . . . 0.0 111.638 -167.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -81.24 6.75 13.11 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 122.485 1.136 . . . . 0.0 108.076 -175.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.48 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 4.2 tm-20 -57.91 -39.12 77.16 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 169.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm . . . . . 0 C--N 1.32 -0.703 0 CA-C-N 113.955 -1.475 . . . . 0.0 113.145 -178.962 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . 0.527 ' O ' HD13 ' A' ' 466' ' ' LEU . 3.2 pp . . . . . 0 N--CA 1.417 -2.091 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 467' ' ' SER . . . . . 0.513 ' HB2' ' OE1' ' A' ' 469' ' ' GLN . 4.0 p -109.64 162.86 14.02 Favored 'General case' 0 C--N 1.279 -2.496 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -176.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . 0.539 ' O ' ' HB2' ' A' ' 471' ' ' LYS . 4.3 ptp180 -64.93 -18.08 64.92 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.252 0.548 . . . . 0.0 112.076 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.513 ' OE1' ' HB2' ' A' ' 467' ' ' SER . 26.3 mp0 -65.15 -27.23 68.57 Favored 'General case' 0 C--N 1.31 -1.122 0 O-C-N 122.072 -0.393 . . . . 0.0 111.922 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.412 ' HA ' ' OE1' ' A' ' 473' ' ' GLU . 2.3 mp0 -67.02 -25.46 66.3 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 120.983 0.421 . . . . 0.0 111.274 173.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.539 ' HB2' ' O ' ' A' ' 468' ' ' ARG . 16.6 mmtp -67.94 -41.1 83.07 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 173.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -65.23 -46.24 81.45 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.368 178.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . 0.576 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 50.1 mt-10 -54.28 -58.46 7.3 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 175.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 41.3 ttt-85 -51.37 -35.26 37.75 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . 0.614 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -62.27 -51.85 66.08 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -63.51 -44.34 94.59 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.71 0.767 . . . . 0.0 112.056 176.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 61.2 mt -73.4 -9.02 58.26 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 -173.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.614 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 24.7 pttm -74.38 -0.6 17.79 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.596 -0.69 . . . . 0.0 112.164 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . 0.408 ' HB2' ' OD1' ' A' ' 483' ' ' ASP . 6.2 p80 -142.75 108.76 5.19 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 124.118 0.967 . . . . 0.0 108.81 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.401 ' O ' ' HB3' ' A' ' 520' ' ' GLN . 93.0 mt -138.04 8.03 2.71 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -172.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 82.9 mtp -94.49 -66.16 0.93 Allowed 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 119.714 -0.795 . . . . 0.0 111.743 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -71.9 -29.15 64.03 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 122.685 1.231 . . . . 0.0 109.862 177.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.53 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 9.3 m-20 -71.11 51.52 0.16 Allowed 'General case' 0 C--N 1.288 -2.091 0 C-N-CA 127.834 2.453 . . . . 0.0 115.424 -172.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -66.19 -39.61 89.83 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -55.26 -46.05 76.12 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-N 114.045 -1.434 . . . . 0.0 109.538 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.53 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 23.5 m -65.53 -40.98 93.55 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 123.494 0.718 . . . . 0.0 111.774 -177.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . 0.404 ' O ' ' HD1' ' A' ' 491' ' ' TYR . 37.8 t80 -60.49 -47.65 85.23 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 4.2 mm? -69.05 -31.57 70.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.904 178.225 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -72.11 -23.82 61.39 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.268 0.556 . . . . 0.0 110.145 177.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -83.48 -23.69 32.09 Favored 'General case' 0 N--CA 1.388 -3.555 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . 0.468 ' HB2' ' O ' ' A' ' 488' ' ' LEU . 28.9 m-85 -62.2 -42.38 99.24 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 167.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -70.84 -44.18 67.0 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.21 -0.905 . . . . 0.0 111.556 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 19.8 m -78.33 -8.87 58.92 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -174.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 87.4 t -122.17 107.83 20.58 Favored 'Isoleucine or valine' 0 C--O 1.249 1.04 0 CA-C-O 121.14 0.495 . . . . 0.0 110.753 -177.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . 0.272 6.9 p30 -150.67 -84.04 0.09 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 178.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.463 ' C ' ' H ' ' A' ' 498' ' ' ASN . 4.0 mptp? -76.73 -13.91 59.99 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.801 0.81 . . . . 0.0 112.059 -177.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -72.46 23.91 0.05 Allowed 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 125.977 1.711 . . . . 0.0 111.533 173.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . 0.463 ' H ' ' C ' ' A' ' 496' ' ' LYS . 4.2 p-10 -77.72 18.08 0.49 Allowed 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 123.722 0.809 . . . . 0.0 112.092 -176.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . 0.411 ' CE1' ' HD3' ' A' ' 566' ' ' LYS . 23.4 p90 -77.79 -22.56 49.94 Favored 'General case' 0 C--O 1.244 0.809 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 175.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 500' ' ' THR . . . . . 0.515 ' HB ' ' CE2' ' A' ' 504' ' ' PHE . 3.9 m -67.48 156.57 36.31 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.088 -1.414 . . . . 0.0 109.56 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.539 ' C ' ' H ' ' A' ' 503' ' ' HIS . 28.4 t-20 -65.72 164.36 14.7 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 124.496 1.118 . . . . 0.0 111.866 -175.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . 0.51 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 7.8 pt20 -58.6 14.32 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 127.201 2.2 . . . . 0.0 113.85 177.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . 0.539 ' H ' ' C ' ' A' ' 501' ' ' ASN . 7.8 t-160 -64.3 -55.47 21.13 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -174.323 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . 0.515 ' CE2' ' HB ' ' A' ' 500' ' ' THR . 0.1 OUTLIER -61.18 -24.18 66.12 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.141 -1.39 . . . . 0.0 114.069 174.824 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.51 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 45.3 tttp -62.14 -52.07 65.31 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.497 ' O ' HG21 ' A' ' 510' ' ' VAL 0.319 2.8 m-85 -69.12 -29.68 67.79 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 178.524 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . 0.41 HG22 ' O ' ' A' ' 503' ' ' HIS . 82.2 t -63.25 -53.7 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.793 175.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -50.09 -53.88 24.23 Favored 'General case' 0 C--O 1.2 -1.536 0 O-C-N 123.166 0.291 . . . . 0.0 111.22 175.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -57.63 -60.05 4.26 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.941 1.46 . . . . 0.0 114.941 -176.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.497 HG21 ' O ' ' A' ' 506' ' ' TYR . 10.9 t -61.81 -43.38 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.478 -176.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 10.4 mp -66.64 -49.13 67.24 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.753 -177.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -61.74 -46.92 87.54 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 123.358 0.663 . . . . 0.0 110.047 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -55.88 -48.67 75.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.951 0.5 . . . . 0.0 111.722 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -70.82 -45.14 65.12 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.94 -178.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -52.59 -39.59 61.75 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 124.772 1.229 . . . . 0.0 109.434 175.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -64.63 -21.37 66.7 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.046 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -106.55 -56.46 2.19 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 121.056 0.455 . . . . 0.0 111.141 -178.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -117.58 -154.41 0.56 Allowed 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -173.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . 0.449 ' CG ' ' H ' ' A' ' 520' ' ' GLN . 16.9 t70 -87.22 -159.82 0.54 Allowed 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 125.849 1.659 . . . . 0.0 107.984 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . 0.449 ' H ' ' CG ' ' A' ' 519' ' ' ASP . 77.4 mm-40 -79.22 155.28 28.67 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -170.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -41.88 134.2 2.67 Favored 'General case' 0 N--CA 1.407 -2.597 0 C-N-CA 128.025 2.53 . . . . 0.0 116.255 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -118.1 158.49 24.93 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 106.308 -1.738 . . . . 0.0 106.308 173.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 45.3 pt -68.48 -23.37 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-O 121.583 0.706 . . . . 0.0 109.417 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 3.0 m -56.35 -40.06 73.87 Favored 'General case' 0 N--CA 1.417 -2.109 0 C-N-CA 125.166 1.386 . . . . 0.0 110.891 177.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . 0.423 ' O ' ' HB3' ' A' ' 528' ' ' GLN . 15.9 m-20 -68.4 -33.88 75.02 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.328 0.585 . . . . 0.0 110.4 179.347 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -64.18 -47.89 78.07 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.642 177.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.86 -18.22 20.72 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.106 0 CA-C-O 121.77 0.795 . . . . 0.0 110.374 176.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . 0.423 ' HB3' ' O ' ' A' ' 525' ' ' ASP . 0.7 OUTLIER -68.17 -31.58 71.23 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 172.58 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.581 ' HB3' ' HG3' ' A' ' 536' ' ' ARG . 0.5 OUTLIER -85.21 11.38 10.07 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.764 175.223 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.565 ' HA ' ' CZ ' ' A' ' 536' ' ' ARG . 2.9 p -72.94 4.98 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -171.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -109.0 -35.99 6.2 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 119.948 -1.72 . . . . 0.0 110.749 176.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 532' ' ' SER . . . . . 0.567 ' O ' ' HG3' ' A' ' 534' ' ' GLU . 24.5 t -80.44 -145.2 0.05 OUTLIER 'General case' 0 CA--C 1.583 2.221 0 CA-C-N 114.474 -1.239 . . . . 0.0 110.342 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . 0.581 ' C ' ' H ' ' A' ' 535' ' ' LEU 0.574 5.3 t-20 -25.34 39.02 0.0 OUTLIER 'General case' 0 CA--C 1.465 -2.325 1 C-N-CA 137.084 6.154 . . . . 0.0 121.61 179.905 . . . . . . . . 4 3 . 1 . 011 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . 0.584 ' HA ' ' CD ' ' A' ' 536' ' ' ARG . 45.9 mt-10 -28.97 6.41 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.813 0 C-N-CA 129.19 2.996 . . . . 0.0 117.384 -177.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.581 ' H ' ' C ' ' A' ' 533' ' ' ASN . 1.0 OUTLIER -72.06 -21.48 61.51 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 162.411 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . 0.584 ' CD ' ' HA ' ' A' ' 534' ' ' GLU . 0.0 OUTLIER -69.59 -18.26 63.6 Favored 'General case' 0 C--N 1.383 2.052 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 172.222 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . 0.56 ' N ' ' HD3' ' A' ' 536' ' ' ARG . 6.1 tp10 -76.95 -41.26 43.96 Favored 'General case' 0 CA--C 1.47 -2.117 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 -178.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.457 ' O ' HD11 ' A' ' 542' ' ' LEU . 27.6 m -54.96 -47.64 74.26 Favored 'General case' 0 N--CA 1.442 -0.873 0 O-C-N 124.05 0.844 . . . . 0.0 108.849 172.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 59.5 tp -56.48 -48.18 77.68 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.267 177.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 536' ' ' ARG . 57.5 mt -63.72 -41.08 91.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-O 120.744 0.307 . . . . 0.0 110.729 178.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.2 m -56.99 -46.44 82.24 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.684 0.754 . . . . 0.0 109.993 174.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.457 HD11 ' O ' ' A' ' 538' ' ' THR . 6.0 mp -67.53 -16.15 64.04 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 124.43 1.092 . . . . 0.0 112.652 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -88.26 -39.85 14.11 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 177.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -67.09 -36.78 82.71 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -68.27 129.18 39.16 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 170.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -74.95 109.06 8.09 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 122.382 1.087 . . . . 0.0 112.189 -168.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -78.96 -13.93 59.51 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 113.3 -1.773 . . . . 0.0 113.505 -177.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -75.94 -6.98 53.48 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.114 0.483 . . . . 0.0 110.666 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -72.59 -8.33 54.67 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.888 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -87.69 149.02 45.25 Favored Pre-proline 0 C--N 1.312 -1.054 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . 0.426 ' O ' ' HB2' ' A' ' 554' ' ' ASN . 23.2 Cg_exo -66.84 129.43 20.87 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.035 1.823 . . . . 0.0 107.99 172.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . 0.56 ' O ' ' HG2' ' A' ' 555' ' ' GLU . 21.6 t80 -82.84 -6.09 59.28 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 121.937 0.875 . . . . 0.0 111.23 -172.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -82.88 -8.63 59.56 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-O 121.773 0.797 . . . . 0.0 111.502 172.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 551' ' ' PRO . 6.6 m-20 -73.04 -22.89 60.55 Favored 'General case' 0 C--O 1.198 -1.622 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.357 177.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 552' ' ' TYR . 18.6 mm-40 -40.0 -83.65 0.01 OUTLIER 'General case' 0 C--O 1.196 -1.73 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -164.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -67.59 -39.27 82.0 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-O 121.573 0.701 . . . . 0.0 110.037 -176.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.88 -59.81 4.85 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.341 -173.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -73.83 -39.25 64.17 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.147 -176.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.508 ' O ' HG13 ' A' ' 563' ' ' ILE . 93.5 t80 -50.34 -53.34 29.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.257 1.023 . . . . 0.0 111.018 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . 0.459 ' O ' ' HB2' ' A' ' 564' ' ' ASN . 53.4 t -64.69 -40.35 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.768 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . 0.429 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 2.4 t-20 -59.04 -45.92 89.52 Favored 'General case' 0 C--O 1.194 -1.833 0 CA-C-O 119.331 -0.366 . . . . 0.0 110.58 175.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . 0.496 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 91.2 t -66.17 -33.15 61.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.508 HG13 ' O ' ' A' ' 559' ' ' TYR . 14.4 mt -87.09 -31.74 6.12 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.983 0 C-N-CA 118.205 -1.398 . . . . 0.0 108.907 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 560' ' ' VAL . 78.5 m-20 -83.53 -2.25 55.56 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.638 176.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.496 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 11.4 tp10 -73.6 -11.17 60.34 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 113.761 -1.563 . . . . 0.0 107.462 175.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . 0.411 ' HD3' ' CE1' ' A' ' 499' ' ' PHE . 38.4 ttpt . . . . . 0 CA--C 1.533 0.318 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.047 172.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 89.8 mt . . . . . 0 N--CA 1.432 -1.329 0 CA-C-O 120.938 0.399 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 37.0 t -88.95 106.57 18.5 Favored 'General case' 0 N--CA 1.421 -1.906 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -66.96 -36.93 83.31 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.432 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -68.23 -45.11 74.17 Favored 'General case' 0 C--O 1.198 -1.644 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.743 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -66.26 -22.85 66.32 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -177.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.407 ' HD3' ' C ' ' A' ' 471' ' ' LYS . 10.1 tmtt? -76.9 -37.39 55.54 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 172.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . 0.445 ' O ' ' HE2' ' A' ' 559' ' ' TYR . . . -64.22 -51.82 61.81 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.31 178.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . 0.556 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 2.2 mp0 -53.42 -43.1 67.71 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 118.079 0.4 . . . . 0.0 110.961 176.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 61.5 mtt85 -53.82 -41.95 67.91 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 120.853 0.359 . . . . 0.0 111.183 172.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . 0.473 ' O ' ' HB3' ' A' ' 478' ' ' LYS . . . -71.23 -28.56 64.28 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 122.965 0.506 . . . . 0.0 112.317 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -35.06 79.68 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.663 -0.648 . . . . 0.0 110.171 176.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 45.9 mt -64.05 -8.99 13.56 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 124.61 1.164 . . . . 0.0 112.178 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 475' ' ' ALA . 80.3 tttt -71.31 -3.96 23.44 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.656 1.582 . . . . 0.0 111.804 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . 0.409 ' CB ' ' HB2' ' A' ' 483' ' ' ASP . 16.9 m170 -96.58 152.47 18.61 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 7.9 mp -122.34 -63.99 1.24 Allowed 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 64.0 mtt -95.21 -57.39 2.43 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -171.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -67.77 -12.7 61.11 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.409 ' HB2' ' CB ' ' A' ' 479' ' ' HIS . 26.2 t70 -75.07 8.36 2.64 Favored 'General case' 0 C--O 1.184 -2.379 0 C-N-CA 124.572 1.149 . . . . 0.0 113.13 -175.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -46.72 -61.81 1.67 Allowed 'General case' 0 C--O 1.275 2.395 0 C-N-CA 124.113 0.965 . . . . 0.0 112.682 -174.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -62.84 -43.14 99.59 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.631 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 28.1 m -60.81 -41.79 96.37 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.468 -177.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . 0.503 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 39.0 t80 -59.7 -47.12 86.9 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 123.061 0.544 . . . . 0.0 109.843 175.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 70.9 mt -66.04 -34.55 78.34 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.463 0.649 . . . . 0.0 110.533 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -67.15 -49.11 65.94 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.711 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . 0.481 ' CZ ' ' HE1' ' A' ' 559' ' ' TYR . 1.3 m-85 -76.96 -8.64 57.74 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . 0.503 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.4 OUTLIER -74.55 -52.39 12.0 Favored 'General case' 0 C--N 1.286 -2.185 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.689 176.348 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.17 -27.86 38.9 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -174.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 19.7 p -81.67 -24.42 36.29 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -176.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 50.6 t -96.68 156.24 3.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.086 0.47 . . . . 0.0 110.445 -175.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -85.91 124.44 32.38 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -176.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.553 ' HA ' ' OG1' ' A' ' 500' ' ' THR . 62.3 pttt -88.75 -15.82 33.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.13 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -69.6 -70.93 0.25 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -175.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -106.9 -31.74 8.21 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.502 -174.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -72.66 -37.35 67.97 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.67 -175.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 500' ' ' THR . . . . . 0.553 ' OG1' ' HA ' ' A' ' 496' ' ' LYS . 76.1 m -71.66 102.45 2.78 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.887 0.851 . . . . 0.0 112.496 -179.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -77.13 163.16 26.85 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.32 -1.309 . . . . 0.0 107.773 174.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -53.97 -34.84 60.89 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.966 0.803 . . . . 0.0 110.566 179.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -57.15 -56.11 25.97 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.981 175.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -66.13 -30.53 71.04 Favored 'General case' 0 CA--C 1.556 1.195 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.736 -178.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -67.3 -47.71 69.77 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 124.12 0.968 . . . . 0.0 110.072 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.565 ' O ' HG22 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -59.74 -45.91 90.75 Favored 'General case' 0 N--CA 1.425 -1.694 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.869 -178.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 11.8 p -68.28 -40.96 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 O-C-N 123.428 0.455 . . . . 0.0 111.049 -176.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -51.28 -53.92 31.0 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.079 0.466 . . . . 0.0 110.558 173.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.37 -41.85 98.95 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.992 -1.004 . . . . 0.0 113.521 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 506' ' ' TYR . 95.7 t -57.55 -52.45 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 CA-C-O 120.889 0.376 . . . . 0.0 110.814 176.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 10.2 mp -66.37 -38.69 88.13 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.949 -177.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -62.99 -49.2 75.61 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.629 0.58 . . . . 0.0 109.555 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -52.64 -51.29 60.73 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.677 0.791 . . . . 0.0 110.75 -179.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -64.11 -53.36 50.87 Favored 'General case' 0 C--O 1.187 -2.223 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.747 177.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . 0.478 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 3.6 t80 -52.0 -35.7 47.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.976 0.91 . . . . 0.0 110.968 -177.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.41 -25.26 62.26 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -117.28 -38.2 3.39 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.778 0.799 . . . . 0.0 111.951 -177.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -124.82 -153.09 0.54 Allowed 'General case' 0 C--N 1.285 -2.233 0 C-N-CA 124.802 1.241 . . . . 0.0 109.16 -171.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -85.2 -162.01 0.66 Allowed 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -82.36 -169.74 2.58 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -177.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -45.43 130.78 8.52 Favored 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 125.48 1.512 . . . . 0.0 114.266 -174.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -118.14 134.41 55.03 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 178.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 1.7 tt -53.72 -26.26 13.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 125.441 1.496 . . . . 0.0 112.029 179.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 48.1 t -54.34 -38.61 66.23 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 122.749 0.42 . . . . 0.0 111.548 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . 0.522 ' O ' ' HB3' ' A' ' 528' ' ' GLN . 2.8 t70 -72.04 -36.91 69.77 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -58.13 -55.53 33.77 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.132 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 530' ' ' VAL . 14.7 p -66.98 -18.84 24.84 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 CA-C-O 121.498 0.666 . . . . 0.0 111.423 179.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . 0.522 ' HB3' ' O ' ' A' ' 525' ' ' ASP . 48.1 tt0 -65.8 -37.75 87.1 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 171.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.487 ' C ' ' H ' ' A' ' 531' ' ' ASN . 76.8 m-85 -79.8 9.48 5.16 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 176.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.439 HG13 ' O ' ' A' ' 527' ' ' VAL . 5.3 p -74.3 16.84 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 CA-C-O 122.413 1.102 . . . . 0.0 110.794 178.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . 0.487 ' H ' ' C ' ' A' ' 529' ' ' TYR . 91.2 m-20 -111.03 -29.57 7.84 Favored 'General case' 0 C--N 1.288 -2.079 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.021 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 12.9 m -81.2 158.52 24.86 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.696 -177.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . 0.475 ' O ' ' HG3' ' A' ' 537' ' ' GLU . 7.8 t30 -65.97 -73.55 0.13 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -177.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -71.93 -32.33 67.23 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -172.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -66.08 -38.53 88.52 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -178.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 11.6 ttm180 -64.4 -56.41 14.48 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 175.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 533' ' ' ASN . 42.4 mt-10 -55.83 -70.19 0.12 Allowed 'General case' 0 C--N 1.347 0.468 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.186 -177.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 8.9 m -64.31 -54.56 31.15 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -172.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 48.8 tp -63.99 -44.27 93.18 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.013 -173.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . 0.586 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 64.8 mt -69.27 -28.23 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.728 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 541' ' ' SER . . . . . 0.447 ' HB2' ' O ' ' A' ' 537' ' ' GLU . 9.0 t -57.43 -44.32 84.57 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 174.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.474 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 3.1 mm? -67.47 -23.53 65.51 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 176.183 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . 0.473 ' C ' ' H ' ' A' ' 545' ' ' TYR . 36.6 tt0 -76.63 -26.61 55.1 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 121.349 0.595 . . . . 0.0 109.773 174.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . 0.586 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 86.2 mt-30 -80.87 31.86 0.31 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 124.11 0.964 . . . . 0.0 110.368 177.268 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . 0.474 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 6.3 p90 -68.09 166.92 15.04 Favored 'General case' 0 N--CA 1.394 -3.27 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.792 -175.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -79.22 156.0 28.35 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 121.688 0.756 . . . . 0.0 112.304 -170.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . 0.43 ' C ' ' H ' ' A' ' 549' ' ' ASP . 3.0 mm? -77.23 6.04 7.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.102 -177.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -79.39 21.9 0.46 Allowed 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 125.162 1.385 . . . . 0.0 110.072 177.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . 0.43 ' H ' ' C ' ' A' ' 547' ' ' LEU . 3.2 p-10 -67.36 0.5 2.85 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -172.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -61.96 140.65 95.73 Favored Pre-proline 0 C--N 1.324 -0.528 0 N-CA-C 104.905 -2.257 . . . . 0.0 104.905 170.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -0.64 66.34 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.094 1 C-N-CA 126.555 4.836 . . . . 0.0 115.532 -167.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -89.89 19.98 4.47 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 122.921 1.343 . . . . 0.0 109.76 -171.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -71.97 -4.6 29.44 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-N 113.577 -1.647 . . . . 0.0 110.854 177.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . 0.606 ' HA ' ' OD2' ' A' ' 557' ' ' ASP . 14.2 m120 -66.56 -23.07 66.16 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.29 172.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.01 -34.06 72.83 Favored 'General case' 0 C--O 1.21 -1.002 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 175.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 57.0 mt -76.45 -39.92 34.07 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.052 0 C-N-CA 124.123 0.969 . . . . 0.0 109.015 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . 0.606 ' OD2' ' HA ' ' A' ' 554' ' ' ASN . 20.1 m-20 -54.82 -54.15 46.02 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-O 121.759 0.79 . . . . 0.0 108.908 174.444 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.21 -50.66 70.62 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 113.538 -1.665 . . . . 0.0 109.564 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.605 ' O ' HG12 ' A' ' 563' ' ' ILE . 52.5 t80 -56.14 -55.07 37.57 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 124.721 1.208 . . . . 0.0 111.304 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 75.6 t -64.97 -37.26 79.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.032 -174.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -61.43 -41.04 96.55 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 176.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . 0.582 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 78.1 t -72.46 -40.47 63.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 C-N-CA 123.859 0.864 . . . . 0.0 113.175 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.605 HG12 ' O ' ' A' ' 559' ' ' TYR . 28.5 mm -89.02 -49.02 14.41 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.906 0 CA-C-O 122.03 0.919 . . . . 0.0 109.519 -170.031 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -77.49 3.5 13.32 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.559 -175.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 6.0 pt-20 -75.47 -23.18 56.82 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 174.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 87.8 tttt . . . . . 0 CA--C 1.548 0.876 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.421 178.236 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 65.6 mt . . . . . 0 N--CA 1.433 -1.281 0 CA-C-O 120.8 0.333 . . . . 0.0 110.384 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 27.3 p -86.84 160.25 18.81 Favored 'General case' 0 C--N 1.292 -1.902 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.994 -177.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -64.11 -29.17 70.31 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.305 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -66.79 -44.43 81.33 Favored 'General case' 0 C--O 1.19 -2.029 0 O-C-N 123.293 0.37 . . . . 0.0 110.32 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.571 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 1.1 tm-20 -62.65 -28.67 70.08 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-O 121.348 0.594 . . . . 0.0 109.639 -178.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.564 ' HD3' ' O ' ' A' ' 471' ' ' LYS . 0.9 OUTLIER -71.2 -35.54 71.6 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 175.033 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -60.52 -48.94 79.56 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . 0.555 ' HB3' ' CD2' ' A' ' 504' ' ' PHE . 1.7 mp0 -58.54 -39.93 81.59 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 121.146 0.498 . . . . 0.0 110.722 175.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.571 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 93.8 mtt180 -62.23 -35.34 78.61 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.22 176.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -66.26 -38.12 87.1 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.651 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . 0.47 ' O ' HD13 ' A' ' 480' ' ' LEU . 1.3 m-85 -65.83 -26.73 67.8 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 174.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . 0.413 HD11 ' CD2' ' A' ' 504' ' ' PHE . 95.1 mt -82.66 -17.08 45.83 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 175.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -40.95 -65.13 0.46 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -168.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . 0.479 ' HA ' ' SD ' ' A' ' 481' ' ' MET . 5.7 t-80 -147.57 36.68 0.89 Allowed 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.131 -1.028 . . . . 0.0 108.869 -174.046 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.47 HD13 ' O ' ' A' ' 476' ' ' PHE . 84.0 mt -115.89 29.57 7.9 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.222 -174.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 481' ' ' MET . . . . . 0.479 ' SD ' ' HA ' ' A' ' 479' ' ' HIS . 2.1 mpp? -76.07 -38.31 57.2 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.759 -176.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -67.82 -48.2 66.89 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-O 121.912 0.863 . . . . 0.0 110.126 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . 0.432 9.0 p-10 -74.51 60.49 0.88 Allowed 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . 0.473 ' HB2' ' CE2' ' A' ' 515' ' ' TYR . 19.5 ptpt -40.83 -30.97 0.14 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.144 2.178 . . . . 0.0 112.858 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -52.17 -50.19 62.3 Favored 'General case' 0 CA--C 1.504 -0.804 0 C-N-CA 124.796 1.238 . . . . 0.0 108.94 176.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 31.6 m -64.28 -35.88 82.27 Favored 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 125.324 1.45 . . . . 0.0 111.968 -177.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -59.32 -53.13 61.7 Favored 'General case' 0 C--O 1.258 1.506 0 CA-C-O 121.76 0.79 . . . . 0.0 109.151 177.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . 0.503 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 4.0 mm? -72.2 -25.06 61.52 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.908 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -65.26 -33.15 75.3 Favored 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 122.982 0.176 . . . . 0.0 110.604 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.79 -33.95 40.07 Favored 'General case' 0 N--CA 1.385 -3.679 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -66.47 -27.33 67.72 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 120.1 -0.64 . . . . 0.0 112.4 173.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 14.4 mm-40 -78.51 -28.28 46.25 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.083 0.468 . . . . 0.0 110.967 175.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 51.0 m -85.09 -49.54 8.18 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.601 0.715 . . . . 0.0 110.986 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.2 t -135.96 100.23 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.526 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.523 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . 0.443 ' C ' ' H ' ' A' ' 497' ' ' ASP . 6.0 p-10 -95.19 14.91 20.61 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 122.405 1.097 . . . . 0.0 109.171 174.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -84.64 21.76 1.45 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 127.073 2.149 . . . . 0.0 109.42 178.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . 0.443 ' H ' ' C ' ' A' ' 495' ' ' ASP . 9.7 t70 -53.16 -1.44 0.02 OUTLIER 'General case' 0 CA--C 1.563 1.46 0 C-N-CA 128.991 2.916 . . . . 0.0 114.709 -176.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -73.88 -0.99 17.69 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 120.686 -1.259 . . . . 0.0 112.033 -175.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -83.46 -18.84 37.2 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.897 177.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 23.4 p -60.87 158.23 13.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -172.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -91.8 167.31 12.25 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.533 175.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -59.84 -24.32 64.11 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 118.453 0.57 . . . . 0.0 110.054 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -54.79 -53.65 52.41 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 175.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . 0.555 ' CD2' ' HB3' ' A' ' 473' ' ' GLU . 10.6 t80 -64.4 -40.02 94.98 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.415 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -57.67 -47.2 82.97 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 123.943 0.777 . . . . 0.0 109.25 -176.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.595 ' O ' HG22 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -60.77 -45.53 93.99 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.135 -179.176 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 45.9 t -62.8 -48.55 87.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 120.385 -0.526 . . . . 0.0 110.221 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -49.54 -49.78 44.68 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.951 0.782 . . . . 0.0 110.654 174.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -58.22 -55.84 29.74 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.946 -177.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.595 HG22 ' O ' ' A' ' 506' ' ' TYR . 12.1 t -57.69 -52.03 62.64 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.492 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 88.9 mt -56.31 -53.05 61.88 Favored 'General case' 0 C--O 1.213 -0.859 0 O-C-N 123.819 0.699 . . . . 0.0 111.421 -176.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -61.64 -38.49 87.87 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.519 0.728 . . . . 0.0 110.588 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -67.49 -52.27 41.22 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.451 -176.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . 0.264 5.0 p90 -73.71 -31.11 63.24 Favored 'General case' 0 C--O 1.192 -1.936 0 C-N-CA 119.008 -1.077 . . . . 0.0 111.985 -178.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . 0.492 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 0.4 OUTLIER -55.67 -41.54 73.8 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.811 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -67.18 -18.69 65.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.151 -0.932 . . . . 0.0 112.497 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -115.67 -44.8 2.93 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 119.948 -0.701 . . . . 0.0 112.168 -178.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -125.59 -151.79 0.49 Allowed 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 124.852 1.261 . . . . 0.0 111.391 -168.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -105.51 -157.49 0.62 Allowed 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 127.047 2.139 . . . . 0.0 110.456 -173.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -60.51 177.68 0.27 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 125.834 1.654 . . . . 0.0 113.876 -170.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -90.29 146.92 23.84 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.87 1.668 . . . . 0.0 109.085 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -118.58 155.33 31.12 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 50.1 pt -64.0 -21.87 29.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 O-C-N 122.249 -0.282 . . . . 0.0 111.567 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 22.7 t -57.66 -34.87 69.82 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -63.71 -50.32 69.65 Favored 'General case' 0 C--N 1.349 0.549 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -59.0 -44.37 91.66 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.594 0.712 . . . . 0.0 110.857 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.506 ' O ' HG22 ' A' ' 530' ' ' VAL . 55.8 t -65.1 -37.46 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.531 0 C-N-CA 124.052 0.941 . . . . 0.0 111.912 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -70.21 -16.85 63.11 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 117.95 -1.5 . . . . 0.0 110.213 175.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.419 ' C ' ' H ' ' A' ' 531' ' ' ASN . 51.8 m-85 -80.59 6.42 12.65 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 172.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 527' ' ' VAL . 26.9 m -74.34 10.63 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.514 173.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . 0.419 ' H ' ' C ' ' A' ' 529' ' ' TYR . 51.2 m-80 -99.12 -15.02 19.13 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.943 177.24 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 532' ' ' SER . . . . . 0.418 ' HB2' ' HB2' ' A' ' 535' ' ' LEU . 27.1 m -88.69 156.2 19.14 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -63.18 -75.01 0.08 Allowed 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -86.4 -28.55 23.51 Favored 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 121.399 0.619 . . . . 0.0 110.257 -173.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 532' ' ' SER . 58.3 mt -62.08 -32.95 73.55 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.942 -174.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -53.84 -63.43 1.15 Allowed 'General case' 0 C--O 1.255 1.37 0 O-C-N 124.293 0.996 . . . . 0.0 109.675 176.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -63.26 -55.72 22.52 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.359 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.403 ' O ' HD12 ' A' ' 542' ' ' LEU . 23.4 m -58.83 -53.81 54.21 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -174.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . 0.299 4.0 mm? -63.88 -40.4 96.45 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -176.493 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 58.6 mt -68.85 -34.91 66.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 118.637 -1.225 . . . . 0.0 109.774 176.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 34.6 t -56.76 -48.91 76.76 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.491 ' HA ' ' CE2' ' A' ' 545' ' ' TYR . 6.6 mp -64.7 -32.22 73.8 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 124.671 1.188 . . . . 0.0 112.454 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.59 -54.83 7.26 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . 0.615 ' HG2' ' O ' ' A' ' 544' ' ' GLN . 46.9 tt0 -74.64 35.08 0.1 Allowed 'General case' 0 CA--C 1.564 1.489 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -173.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . 0.491 ' CE2' ' HA ' ' A' ' 542' ' ' LEU . 16.6 m-85 -77.28 166.35 23.29 Favored 'General case' 0 C--N 1.265 -3.105 0 O-C-N 120.491 -1.38 . . . . 0.0 110.882 170.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -93.5 117.85 30.59 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 92.8 mt -74.43 -16.27 60.88 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.199 -176.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -70.5 -43.07 70.44 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.838 177.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . 0.441 ' C ' ' HD3' ' A' ' 551' ' ' PRO . 40.6 m-20 -74.81 1.21 13.1 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.424 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.408 ' N ' ' HD3' ' A' ' 551' ' ' PRO . 35.6 tt0 -119.59 67.99 10.83 Favored Pre-proline 0 CA--C 1.567 1.623 0 C-N-CA 119.262 -0.975 . . . . 0.0 113.039 -175.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . 0.465 ' HD2' ' H ' ' A' ' 552' ' ' TYR . 72.1 Cg_endo -119.25 -14.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.579 2.747 0 C-N-CA 122.24 1.96 . . . . 0.0 114.658 168.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . 0.465 ' H ' ' HD2' ' A' ' 551' ' ' PRO . 48.7 m-85 -114.15 52.8 0.81 Allowed 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 124.773 1.229 . . . . 0.0 108.287 -171.206 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . 0.42 ' HA ' ' OE1' ' A' ' 553' ' ' GLU 0.277 7.5 mm-40 -58.84 67.84 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 118.622 2.823 . . . . 0.0 118.622 -170.049 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -65.94 -20.95 66.38 Favored 'General case' 0 C--O 1.194 -1.816 0 CA-C-N 113.649 -1.614 . . . . 0.0 108.992 169.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -43.91 -41.01 4.95 Favored 'General case' 0 C--O 1.204 -1.294 0 C-N-CA 124.611 1.164 . . . . 0.0 111.519 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 62.1 mt -64.17 -45.32 96.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -60.03 -45.49 92.62 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.256 175.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . 0.503 ' O ' HG23 ' A' ' 562' ' ' VAL . 18.4 t70 -58.16 -56.34 23.34 Favored 'General case' 0 CA--C 1.503 -0.828 0 C-N-CA 124.404 1.082 . . . . 0.0 109.407 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -48.03 -53.16 17.21 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 125.28 1.432 . . . . 0.0 110.138 176.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 37.2 t -57.69 -50.94 75.84 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.949 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.772 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.04 -31.41 71.82 Favored 'General case' 0 C--O 1.209 -1.034 0 C-N-CA 123.3 0.64 . . . . 0.0 111.677 -179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 558' ' ' ASP . 78.0 t -69.0 -34.71 65.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 CA-C-O 121.329 0.585 . . . . 0.0 111.776 178.088 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . . . . . . . . . 57.3 mt -87.41 -35.67 8.72 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.248 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -77.62 2.57 16.22 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 113.694 -1.594 . . . . 0.0 109.83 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.32 -31.09 67.01 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 174.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp . . . . . 0 C--N 1.313 -0.991 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -174.442 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 96.5 mt . . . . . 0 N--CA 1.431 -1.388 0 CA-C-O 121.37 0.605 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 15.0 m -95.16 150.34 20.31 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.891 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' A' ' 471' ' ' LYS . 19.9 tpp180 -60.98 -20.38 62.32 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.621 1.169 . . . . 0.0 110.712 -178.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.631 HE21 ' N ' ' A' ' 469' ' ' GLN . 0.0 OUTLIER -58.99 -40.57 85.25 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.642 177.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.579 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 34.2 tt0 -67.03 -30.81 71.0 Favored 'General case' 0 C--O 1.203 -1.345 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 468' ' ' ARG . 27.1 tptp -62.48 -37.93 87.88 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.904 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -64.44 -45.43 87.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.559 0.695 . . . . 0.0 109.239 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.94 -33.46 74.31 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.745 177.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.579 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 98.9 mtt180 -65.92 -36.8 84.37 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 122.459 0.304 . . . . 0.0 110.524 175.118 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -65.9 -45.5 81.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.307 0.575 . . . . 0.0 109.954 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.28 -27.78 68.71 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 122.031 0.919 . . . . 0.0 111.173 175.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . 0.478 ' HB3' ' O ' ' A' ' 474' ' ' ARG . 61.8 tp -77.22 -14.83 59.7 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 126.004 1.722 . . . . 0.0 113.557 -175.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -41.12 -50.26 3.46 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.312 1.045 . . . . 0.0 110.833 -173.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -168.2 128.23 1.28 Allowed 'General case' 0 CA--C 1.48 -1.73 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 166.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.498 ' HG ' ' OD2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -58.48 119.49 7.09 Favored 'General case' 0 C--O 1.251 1.145 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 -179.599 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 72.8 mtm -93.21 -53.57 4.05 Favored 'General case' 0 N--CA 1.424 -1.759 0 N-CA-C 115.343 1.608 . . . . 0.0 115.343 -172.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . 0.636 ' HB2' ' OG1' ' A' ' 486' ' ' THR 0.255 36.4 mmt180 -76.33 -99.05 0.02 OUTLIER 'General case' 0 C--O 1.212 -0.875 0 C-N-CA 116.379 -2.129 . . . . 0.0 114.409 -174.263 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.637 ' OD2' ' HG3' ' A' ' 484' ' ' LYS . 25.4 t70 -145.72 -86.89 0.11 Allowed 'General case' 0 C--O 1.196 -1.726 0 C-N-CA 115.639 -2.424 . . . . 0.0 116.819 170.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . 0.637 ' HG3' ' OD2' ' A' ' 483' ' ' ASP . 61.8 mttp -97.54 -52.33 3.82 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.669 -1.15 . . . . 0.0 113.464 -178.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -56.45 -42.75 78.69 Favored 'General case' 0 CA--C 1.497 -1.085 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.88 -178.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.636 ' OG1' ' HB2' ' A' ' 482' ' ' ARG . 42.2 m -61.51 -37.57 84.2 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.975 -177.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -62.62 -54.12 44.32 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.658 177.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . 0.476 HD11 ' HH ' ' A' ' 515' ' ' TYR . 77.5 mt -66.8 -28.46 68.4 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -61.49 -40.97 96.5 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 123.765 0.826 . . . . 0.0 110.659 -179.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -92.51 -37.15 12.67 Favored 'General case' 0 N--CA 1.399 -3.02 0 C-N-CA 120.486 -0.485 . . . . 0.0 110.732 178.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -79.95 -59.65 2.64 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -175.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -78.82 -7.4 57.83 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.839 0.828 . . . . 0.0 111.751 -166.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 18.2 m -75.51 -6.8 52.04 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.469 177.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 46.0 t -100.27 99.22 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -97.45 -82.84 0.41 Allowed 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.424 ' C ' ' H ' ' A' ' 498' ' ' ASN . 29.3 mmmt -83.17 -26.88 30.49 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.575 0.702 . . . . 0.0 110.876 -179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . 0.48 ' C ' ' H ' ' A' ' 499' ' ' PHE . 38.0 t70 -77.56 31.09 0.15 Allowed 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 125.574 1.55 . . . . 0.0 110.914 -178.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . 0.424 ' H ' ' C ' ' A' ' 496' ' ' LYS . 3.9 p-10 -72.93 33.53 0.07 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.688 1.195 . . . . 0.0 111.78 -177.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . 0.48 ' H ' ' C ' ' A' ' 497' ' ' ASP . 15.1 p90 -73.52 -13.81 61.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.055 -179.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.84 150.78 31.78 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -74.72 163.81 27.28 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 114.801 -1.091 . . . . 0.0 112.052 -172.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . 0.466 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 8.7 tt0 -56.18 -5.22 0.17 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.438 1.895 . . . . 0.0 111.839 177.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -52.6 -45.17 66.43 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 172.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.84 -30.31 70.03 Favored 'General case' 0 C--O 1.204 -1.301 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.646 175.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . 0.466 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 22.1 tptm -70.35 -47.75 59.54 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.241 0.617 . . . . 0.0 110.332 -175.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.51 ' O ' HG22 ' A' ' 510' ' ' VAL . 96.9 m-85 -59.63 -46.8 87.92 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . 0.425 ' CG2' HD11 ' A' ' 477' ' ' LEU . 71.1 t -58.25 -57.49 10.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 114.227 -1.351 . . . . 0.0 111.263 178.134 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -48.41 -45.59 36.32 Favored 'General case' 0 C--O 1.212 -0.885 0 O-C-N 124.047 0.842 . . . . 0.0 112.349 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.3 -53.77 52.46 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.048 0.452 . . . . 0.0 110.491 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 506' ' ' TYR . 24.5 t -60.85 -51.35 74.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 CA-C-O 121.368 0.604 . . . . 0.0 111.097 -178.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 10.4 mp -66.91 -34.05 76.92 Favored 'General case' 0 C--O 1.2 -1.546 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.482 -175.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -65.85 -29.53 70.0 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 120.99 0.424 . . . . 0.0 110.548 176.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.12 -37.05 80.7 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -76.46 -46.16 28.1 Favored 'General case' 0 C--O 1.2 -1.551 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.324 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . 0.476 ' HH ' HD11 ' A' ' 488' ' ' LEU . 42.7 t80 -46.21 -32.83 3.24 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.901 1.68 . . . . 0.0 111.129 176.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -57.55 -29.8 64.69 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.783 178.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . 0.415 ' HG3' HD21 ' A' ' 518' ' ' ASN . 11.5 tp10 -119.77 -59.73 1.78 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.016 175.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . 0.415 HD21 ' HG3' ' A' ' 517' ' ' GLU . 6.5 p30 -158.31 124.32 4.61 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 176.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . 0.498 ' OD2' ' HG ' ' A' ' 480' ' ' LEU . 24.3 t0 -95.4 96.75 9.32 Favored 'General case' 0 CA--C 1.484 -1.572 0 C-N-CA 117.274 -1.77 . . . . 0.0 110.468 179.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 482' ' ' ARG . 88.5 mt-30 -137.86 77.1 1.61 Allowed 'General case' 0 C--N 1.274 -2.7 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 178.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -46.53 121.05 3.21 Favored 'General case' 0 N--CA 1.427 -1.588 0 C-N-CA 126.093 1.757 . . . . 0.0 113.039 -174.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -91.02 167.13 12.61 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.602 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 44.7 pt -87.07 -17.37 8.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 C-N-CA 120.166 -0.614 . . . . 0.0 112.132 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 23.0 t -60.16 -46.17 90.6 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.19 -38.04 87.6 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.676 176.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -60.37 -48.03 83.53 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 120.998 0.428 . . . . 0.0 110.409 176.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.504 ' O ' HG21 ' A' ' 530' ' ' VAL . 97.5 t -64.98 -30.71 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 C-N-CA 123.719 0.807 . . . . 0.0 111.018 177.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -65.1 -32.55 74.31 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.416 -0.802 . . . . 0.0 109.159 172.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -77.71 10.78 2.47 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 176.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.504 HG21 ' O ' ' A' ' 527' ' ' VAL . 22.1 m -75.26 6.79 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 118.313 -1.355 . . . . 0.0 111.264 171.412 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -93.59 -8.06 42.28 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.079 175.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 20.1 m -85.66 154.76 21.45 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 176.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -71.71 -73.11 0.19 Allowed 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 178.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -81.22 -36.8 29.58 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.837 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 43.9 tp -65.16 -34.6 78.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.865 -177.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 38.2 ttp180 -57.89 -54.53 45.88 Favored 'General case' 0 C--O 1.254 1.315 0 CA-C-O 121.718 0.77 . . . . 0.0 109.344 176.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -53.42 -70.34 0.09 Allowed 'General case' 0 N--CA 1.425 -1.696 0 CA-C-N 113.369 -1.741 . . . . 0.0 110.669 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.426 ' O ' HD11 ' A' ' 542' ' ' LEU 0.291 6.4 p -64.4 -52.69 56.91 Favored 'General case' 0 N--CA 1.425 -1.688 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -173.18 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 51.8 tp -59.03 -44.43 91.74 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -174.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 1.8 mp -75.04 -38.87 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 119.551 -0.86 . . . . 0.0 109.43 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 30.1 t -55.41 -45.6 76.71 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.484 175.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 545' ' ' TYR . 5.2 mp -64.95 -37.53 87.96 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.063 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . 0.512 ' C ' ' H ' ' A' ' 545' ' ' TYR . 13.1 tp10 -64.99 -33.62 76.49 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.884 0.373 . . . . 0.0 110.886 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -76.43 40.9 0.23 Allowed 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 123.048 1.404 . . . . 0.0 110.67 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . 0.521 ' HB2' ' O ' ' A' ' 542' ' ' LEU . 2.8 t80 -72.09 -172.69 0.92 Allowed 'General case' 0 C--N 1.283 -2.294 0 C-N-CA 128.658 2.783 . . . . 0.0 110.658 -176.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . 0.486 ' HB2' ' OD1' ' A' ' 548' ' ' ASN . 1.6 m-80 -85.98 172.08 10.94 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -80.02 14.19 1.94 Allowed 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.158 0.504 . . . . 0.0 111.689 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . 0.486 ' OD1' ' HB2' ' A' ' 546' ' ' ASN . 3.6 p-10 -75.94 -2.03 28.39 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 123.901 0.88 . . . . 0.0 112.472 -176.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -69.75 33.34 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.428 ' H ' ' C ' ' A' ' 548' ' ' ASN . 46.2 mt-10 -103.15 -176.99 0.48 Allowed Pre-proline 0 C--N 1.305 -1.336 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 172.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 550' ' ' GLU . 33.7 Cg_exo -62.97 61.95 0.16 Allowed 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.433 2.089 . . . . 0.0 113.807 176.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -135.22 37.73 2.97 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 105.839 -1.911 . . . . 0.0 105.839 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -67.9 67.12 0.1 Allowed 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -171.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -71.3 -21.45 62.07 Favored 'General case' 0 CA--C 1.491 -1.31 0 C-N-CA 125.279 1.432 . . . . 0.0 108.573 172.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -45.17 -45.31 11.46 Favored 'General case' 0 C--O 1.207 -1.174 0 C-N-CA 124.63 1.172 . . . . 0.0 109.222 171.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 53.9 mt -67.4 -44.21 87.13 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.447 0 O-C-N 123.649 0.593 . . . . 0.0 109.483 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -59.14 -47.34 85.64 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 120.97 0.415 . . . . 0.0 111.152 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.83 -42.47 81.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.073 0.549 . . . . 0.0 110.286 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.563 ' O ' HG12 ' A' ' 563' ' ' ILE . 93.4 t80 -53.6 -51.57 62.6 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.809 1.244 . . . . 0.0 108.763 173.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 9.6 t -55.07 -52.19 46.75 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.751 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.483 175.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -55.57 -38.01 68.78 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.34 0.656 . . . . 0.0 111.441 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 62.9 t -73.6 -32.93 37.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 177.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.563 HG12 ' O ' ' A' ' 559' ' ' TYR . 42.0 mm -90.59 -33.87 6.15 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.956 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -174.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -86.61 14.64 6.6 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 113.783 -1.553 . . . . 0.0 108.14 176.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -70.85 -19.76 62.61 Favored 'General case' 0 C--N 1.347 0.459 0 N-CA-C 105.494 -2.039 . . . . 0.0 105.494 169.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . 0.411 ' HE2' ' OE1' ' A' ' 469' ' ' GLN . 74.3 mmtt . . . . . 0 CA--C 1.548 0.878 0 CA-C-N 113.783 -1.553 . . . . 0.0 109.571 173.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 75.7 mt . . . . . 0 C--O 1.252 1.196 0 CA-C-O 120.92 0.39 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 20.0 m -99.5 133.66 43.5 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 36.5 ttm105 -60.01 -23.61 63.81 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.489 1.138 . . . . 0.0 109.255 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.559 ' O ' ' HG2' ' A' ' 473' ' ' GLU . 82.4 mt-30 -54.45 -38.14 66.01 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 126.4 1.88 . . . . 0.0 113.308 -177.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 1.8 tm-20 -68.45 -39.16 81.58 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.337 0.589 . . . . 0.0 109.629 -175.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -67.73 -33.5 74.99 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.992 175.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -70.19 -39.98 74.91 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.703 178.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 469' ' ' GLN . 6.6 mm-40 -60.88 -39.75 90.39 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 95.4 mtt180 -59.49 -47.2 86.43 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.898 176.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -65.36 -35.42 80.91 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.054 -178.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.63 -57.63 12.15 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.906 0.754 . . . . 0.0 109.42 179.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 27.3 mt -67.74 -31.61 71.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.553 -175.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . 0.281 23.3 mmmt -102.54 -5.86 23.49 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 116.917 2.191 . . . . 0.0 116.917 -175.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 24.7 m170 -99.4 -22.32 15.59 Favored 'General case' 0 CA--C 1.488 -1.437 0 C-N-CA 119.21 -0.996 . . . . 0.0 110.848 173.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 48.6 tp -115.98 102.26 9.5 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 24.0 mmt -67.49 -26.36 66.32 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 122.394 1.093 . . . . 0.0 108.253 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . 0.621 ' HA ' ' NE2' ' A' ' 520' ' ' GLN . 3.4 mpt_? -69.14 -7.1 33.04 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 113.707 -1.588 . . . . 0.0 113.858 176.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.46 ' CG ' ' HB ' ' A' ' 486' ' ' THR . 3.4 t70 -71.4 56.8 0.25 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 122.517 1.151 . . . . 0.0 111.889 -176.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . 0.509 ' O ' ' HB3' ' A' ' 487' ' ' PHE . 82.3 tttt -93.77 -63.87 1.15 Allowed 'General case' 0 C--O 1.268 2.066 0 CA-C-O 123.066 1.412 . . . . 0.0 107.84 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -60.92 -46.18 91.68 Favored 'General case' 0 CA--C 1.491 -1.307 0 CA-C-N 113.546 -1.661 . . . . 0.0 108.059 175.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.46 ' HB ' ' CG ' ' A' ' 483' ' ' ASP . 1.3 m -62.16 -35.7 79.6 Favored 'General case' 0 C--O 1.189 -2.127 0 CA-C-N 114.251 -1.34 . . . . 0.0 110.957 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . 0.509 ' HB3' ' O ' ' A' ' 484' ' ' LYS . 7.4 t80 -51.35 -56.37 13.47 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.132 0.492 . . . . 0.0 110.708 174.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.58 -27.47 62.21 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 118.541 -1.264 . . . . 0.0 110.667 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -75.18 -32.22 61.19 Favored 'General case' 0 C--O 1.211 -0.964 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . 0.435 ' HD1' ' O ' ' A' ' 487' ' ' PHE . 0.0 OUTLIER -73.53 -37.68 65.53 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 -178.502 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 4.0 t80 -65.42 -42.26 92.69 Favored 'General case' 0 N--CA 1.411 -2.424 0 CA-C-N 112.467 -2.151 . . . . 0.0 109.706 -177.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -81.6 -32.21 32.16 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.181 -176.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 35.1 m -83.45 -51.29 7.49 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.9 t -128.93 99.06 4.53 Favored 'Isoleucine or valine' 0 C--O 1.244 0.777 0 C-N-CA 118.067 -1.453 . . . . 0.0 113.363 -170.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 35.8 t70 34.26 87.04 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 127.701 2.4 . . . . 0.0 116.929 172.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 5.9 ptmt -90.14 -43.49 10.42 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 177.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.82 -61.53 2.55 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 -161.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -78.94 -10.99 59.98 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 118.769 -1.172 . . . . 0.0 110.723 -174.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -86.04 -17.02 36.33 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.778 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 30.3 m -63.02 113.73 3.27 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -174.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -94.49 150.06 20.63 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 171.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -57.88 -34.15 69.46 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.276 0.489 . . . . 0.0 111.025 -177.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -64.99 -50.37 66.6 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 124.138 0.975 . . . . 0.0 109.726 -178.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -64.65 -31.09 72.16 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.747 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -65.38 -35.61 81.48 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.459 ' CG ' HD11 ' A' ' 535' ' ' LEU . 12.0 m-85 -59.21 -43.47 92.26 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.686 173.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 9.7 t -61.73 -46.22 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 120.368 -0.533 . . . . 0.0 109.724 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -49.05 -44.44 41.72 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 123.406 0.441 . . . . 0.0 110.625 175.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -60.3 -48.28 82.43 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.035 -179.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.467 HG21 ' CE2' ' A' ' 529' ' ' TYR . 2.9 t -57.19 -43.49 81.82 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.847 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.62 ' O ' ' HB3' ' A' ' 514' ' ' PHE . 94.7 mt -73.27 -34.27 65.71 Favored 'General case' 0 CA--C 1.565 1.544 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -176.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 30.3 t60 -67.43 -42.92 82.39 Favored 'General case' 0 C--O 1.259 1.566 0 CA-C-O 122.257 1.027 . . . . 0.0 108.541 174.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.65 -25.42 65.71 Favored 'General case' 0 C--O 1.172 -3.019 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.52 174.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . 0.824 ' O ' ' HA ' ' A' ' 518' ' ' ASN . 34.0 t80 -71.19 -16.39 62.52 Favored 'General case' 0 C--O 1.18 -2.58 0 C-N-CA 127.096 2.159 . . . . 0.0 111.459 174.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -79.85 -44.5 20.39 Favored 'General case' 0 C--N 1.28 -2.429 0 O-C-N 121.406 -0.809 . . . . 0.0 110.747 167.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.84 -53.48 32.09 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 123.119 1.438 . . . . 0.0 108.692 175.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -95.33 63.64 2.58 Favored 'General case' 0 C--N 1.281 -2.404 0 C-N-CA 129.003 2.921 . . . . 0.0 104.842 173.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . 0.824 ' HA ' ' O ' ' A' ' 514' ' ' PHE . 12.0 t-20 -59.32 -148.18 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.352 0 C-N-CA 129.886 3.275 . . . . 0.0 114.673 -164.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . 0.64 ' OD2' ' HG3' ' A' ' 520' ' ' GLN . 0.8 OUTLIER -34.07 -167.96 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.579 0 N-CA-C 120.079 3.363 . . . . 0.0 120.079 -136.817 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . 0.64 ' HG3' ' OD2' ' A' ' 519' ' ' ASP 0.313 59.0 mt-30 -59.44 135.68 57.74 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 120.941 3.682 . . . . 0.0 120.941 -146.456 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . 0.464 ' N ' ' HE1' ' A' ' 514' ' ' PHE . 5.2 t80 -41.61 133.37 2.67 Favored 'General case' 0 N--CA 1.416 -2.131 0 C-N-CA 131.09 3.756 . . . . 0.0 114.989 -177.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -119.25 163.91 16.42 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.336 172.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 5.7 tt -54.17 -32.83 23.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 C-N-CA 124.225 1.01 . . . . 0.0 111.002 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.456 ' HA ' HG12 ' A' ' 527' ' ' VAL . 34.8 p -59.48 -32.79 70.57 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.212 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -69.89 -44.07 70.49 Favored 'General case' 0 C--O 1.254 1.314 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -61.03 -51.4 69.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.869 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.456 HG12 ' HA ' ' A' ' 524' ' ' SER . 9.9 p -69.21 -13.62 17.47 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.0 0 C-N-CA 123.14 0.576 . . . . 0.0 110.747 177.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -69.71 -33.85 73.09 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.467 ' CE2' HG21 ' A' ' 510' ' ' VAL 0.256 1.0 OUTLIER -80.63 15.85 1.57 Allowed 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 172.392 . . . . . . . . 4 4 . 1 . 015 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . . . . . . . . . 3.7 p -73.36 5.17 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.042 0 CA-C-O 121.699 0.761 . . . . 0.0 109.83 177.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 529' ' ' TYR . 58.8 t30 -95.55 -14.76 23.34 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.702 0.801 . . . . 0.0 110.745 -175.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 8.7 t -106.36 124.49 49.67 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 175.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -58.4 -44.04 88.84 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -170.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.25 -39.7 39.43 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -178.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.459 HD11 ' CG ' ' A' ' 506' ' ' TYR . 96.7 mt -67.36 -36.4 81.31 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-O 119.429 -0.32 . . . . 0.0 111.649 177.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -49.26 -67.53 0.26 Allowed 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 124.388 1.055 . . . . 0.0 110.522 179.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -62.13 -43.82 98.0 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.439 -176.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.457 ' O ' HD12 ' A' ' 542' ' ' LEU . 12.0 m -63.08 -54.62 35.16 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 120.217 -0.593 . . . . 0.0 112.542 -178.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.23 -37.01 85.55 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 38.5 mm -68.14 -38.87 80.38 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 70.1 m -57.03 -41.05 77.89 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.192 0.52 . . . . 0.0 110.741 171.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.457 HD12 ' O ' ' A' ' 538' ' ' THR . 7.8 mp -70.65 -24.77 62.77 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 123.198 0.599 . . . . 0.0 112.129 176.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -84.86 -35.87 21.93 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.658 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -71.33 29.51 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -176.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -61.93 148.67 42.9 Favored 'General case' 0 C--O 1.257 1.481 0 CA-C-O 121.707 0.765 . . . . 0.0 111.894 -175.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . 0.423 ' C ' ' H ' ' A' ' 548' ' ' ASN . 63.8 t30 -84.04 -176.37 6.24 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.351 -171.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . 0.453 ' C ' ' H ' ' A' ' 549' ' ' ASP . 7.4 mp -72.27 17.97 0.1 Allowed 'General case' 0 C--O 1.205 -1.253 0 C-N-CA 124.461 1.105 . . . . 0.0 112.458 -179.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . 0.449 ' C ' ' H ' ' A' ' 550' ' ' GLU . 17.0 m120 -75.04 20.83 0.13 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.149 0.98 . . . . 0.0 111.774 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . 0.453 ' H ' ' C ' ' A' ' 547' ' ' LEU . 25.1 t70 -72.69 33.06 0.07 Allowed 'General case' 0 CA--C 1.569 1.689 0 C-N-CA 125.972 1.709 . . . . 0.0 111.911 -176.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.449 ' H ' ' C ' ' A' ' 548' ' ' ASN . 17.0 mm-40 -73.94 170.54 14.09 Favored Pre-proline 0 C--N 1.304 -1.387 0 C-N-CA 124.852 1.261 . . . . 0.0 108.649 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -69.27 73.97 1.1 Allowed 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 121.862 1.708 . . . . 0.0 110.21 171.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -96.24 42.33 1.09 Allowed 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 126.495 1.918 . . . . 0.0 108.356 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . 0.563 ' O ' HG12 ' A' ' 556' ' ' ILE . 50.3 mt-10 -71.44 1.02 6.97 Favored 'General case' 0 C--N 1.281 -2.41 0 CA-C-N 114.633 -1.167 . . . . 0.0 112.464 -178.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . 0.417 ' O ' ' HB2' ' A' ' 557' ' ' ASP . 15.6 m120 -68.36 -21.47 64.72 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.956 1.702 . . . . 0.0 108.909 171.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -46.01 -49.18 16.39 Favored 'General case' 0 C--N 1.347 0.498 0 C-N-CA 124.065 0.946 . . . . 0.0 110.476 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . 0.563 HG12 ' O ' ' A' ' 553' ' ' GLU . 45.4 pt -64.67 -36.46 77.55 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 C-N-CA 123.342 0.657 . . . . 0.0 110.852 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . 0.417 ' HB2' ' O ' ' A' ' 554' ' ' ASN . 14.3 m-20 -61.31 -50.9 71.09 Favored 'General case' 0 C--O 1.251 1.167 0 C-N-CA 123.533 0.733 . . . . 0.0 110.693 178.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . 0.448 ' O ' HG21 ' A' ' 562' ' ' VAL . 13.1 t70 -66.99 -42.89 84.3 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.733 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.623 ' CZ ' HG13 ' A' ' 563' ' ' ILE . 52.9 t80 -54.19 -53.85 47.88 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.936 178.009 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 32.0 t -55.12 -47.46 77.22 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.383 0 C-N-CA 122.796 0.438 . . . . 0.0 111.537 -177.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . 0.535 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 47.9 t30 -59.02 -47.24 85.94 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 122.342 0.257 . . . . 0.0 110.523 176.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . 0.448 HG21 ' O ' ' A' ' 558' ' ' ASP . 83.1 t -63.8 -41.76 93.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 121.436 0.636 . . . . 0.0 111.877 -178.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.623 HG13 ' CZ ' ' A' ' 559' ' ' TYR . 50.4 mm -83.25 -33.9 10.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.016 0 CA-C-O 121.489 0.662 . . . . 0.0 109.866 -172.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -73.95 -12.15 60.56 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 34.3 mt-10 -63.43 -15.75 58.57 Favored 'General case' 0 C--N 1.362 1.151 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.737 174.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 95.9 mttt . . . . . 0 N--CA 1.489 1.501 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.339 175.161 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 6.7 mp . . . . . 0 N--CA 1.429 -1.494 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 48.4 m -75.32 106.0 6.63 Favored 'General case' 0 N--CA 1.42 -1.938 0 CA-C-O 121.554 0.692 . . . . 0.0 111.087 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -69.82 -16.16 63.23 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.404 175.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -59.66 -48.31 82.19 Favored 'General case' 0 C--O 1.189 -2.087 0 O-C-N 123.415 0.447 . . . . 0.0 110.075 173.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -60.0 -30.66 69.29 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-O 122.181 0.991 . . . . 0.0 109.887 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 28.3 mmtm -72.85 -32.13 65.24 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.374 174.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.49 -44.51 64.57 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.963 -178.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' A' ' 477' ' ' LEU . 3.0 mp0 -55.6 -44.97 77.5 Favored 'General case' 0 C--N 1.349 0.581 0 O-C-N 123.349 0.406 . . . . 0.0 110.026 173.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -44.83 95.48 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -64.01 -51.19 65.38 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.752 0.31 . . . . 0.0 111.053 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -18.97 64.58 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-O 121.337 0.589 . . . . 0.0 111.758 -179.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . 0.481 HD13 ' O ' ' A' ' 477' ' ' LEU . 3.0 tm? -77.25 -26.91 53.02 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 123.868 0.867 . . . . 0.0 110.423 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 33.8 tttm -53.65 -70.67 0.09 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.234 0.614 . . . . 0.0 111.012 -172.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . 0.428 ' HB3' ' CB ' ' A' ' 483' ' ' ASP . 32.5 m80 61.54 -170.53 0.16 Allowed 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.962 0.905 . . . . 0.0 112.347 176.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 91.5 mt -115.11 175.54 5.46 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 167.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 481' ' ' MET . . . . . 0.406 ' HG3' ' O ' ' A' ' 521' ' ' TYR . 1.6 mpt? -73.6 -17.81 61.13 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 121.472 0.653 . . . . 0.0 110.282 -178.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -65.12 -35.03 79.84 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.802 175.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.428 ' CB ' ' HB3' ' A' ' 479' ' ' HIS . 26.9 m-20 -70.85 52.79 0.15 Allowed 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 116.371 1.989 . . . . 0.0 116.371 -169.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -70.7 -42.45 70.63 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.83 -51.78 66.84 Favored 'General case' 0 CA--C 1.501 -0.938 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.797 177.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.424 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 6.0 m -59.73 -32.93 71.01 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.245 -177.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -59.94 -54.82 41.61 Favored 'General case' 0 C--N 1.347 0.464 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 173.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.98 -29.85 67.05 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.872 -178.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -65.02 -41.72 95.03 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 121.259 0.552 . . . . 0.0 109.794 -178.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -83.97 -37.91 21.66 Favored 'General case' 0 N--CA 1.411 -2.421 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.123 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -63.36 -40.08 96.29 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -73.63 -20.3 60.62 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.516 0.674 . . . . 0.0 110.305 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 39.4 m -79.02 -11.65 60.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.109 177.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . 0.476 HG13 ' HB2' ' A' ' 497' ' ' ASP . 55.1 t -94.97 129.85 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.234 0 CA-C-N 115.309 -0.859 . . . . 0.0 108.842 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -156.09 -60.37 0.1 Allowed 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.703 175.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -82.06 -19.68 39.79 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 122.103 0.954 . . . . 0.0 109.561 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . 0.476 ' HB2' HG13 ' A' ' 494' ' ' VAL . 0.6 OUTLIER -69.31 -0.9 6.89 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 126.203 1.801 . . . . 0.0 111.172 -177.523 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -75.59 19.6 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.295 0.638 . . . . 0.0 111.822 -179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . 0.413 ' H ' ' C ' ' A' ' 497' ' ' ASP . 41.1 p90 -79.02 -16.99 56.11 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 173.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.6 t -58.96 168.41 1.3 Allowed 'General case' 0 CA--C 1.559 1.29 0 C-N-CA 124.843 1.257 . . . . 0.0 111.997 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.24 167.31 10.47 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -175.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -63.59 -12.84 36.31 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.572 1.549 . . . . 0.0 109.55 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -56.23 -44.34 79.51 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 124.721 1.208 . . . . 0.0 109.243 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -60.49 -34.87 74.69 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.954 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -70.12 -43.88 70.06 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -176.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.519 ' O ' HG21 ' A' ' 510' ' ' VAL . 73.9 m-85 -59.89 -46.16 90.21 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.448 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . 0.409 HG21 ' HG ' ' A' ' 477' ' ' LEU . 27.1 m -71.07 -47.17 63.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-O 118.916 -0.564 . . . . 0.0 112.282 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -51.53 -48.87 62.86 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 123.585 0.553 . . . . 0.0 111.835 176.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.91 -52.07 65.41 Favored 'General case' 0 C--O 1.242 0.694 0 O-C-N 124.029 0.83 . . . . 0.0 110.346 -178.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.519 HG21 ' O ' ' A' ' 506' ' ' TYR . 79.0 t -60.18 -50.85 78.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.311 178.067 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 92.5 mt -58.53 -55.77 30.78 Favored 'General case' 0 C--O 1.198 -1.625 0 O-C-N 124.078 0.861 . . . . 0.0 111.741 -176.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -59.95 -39.06 84.28 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.57 0.544 . . . . 0.0 111.694 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -66.04 -51.43 58.29 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.645 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -71.3 -39.29 71.55 Favored 'General case' 0 C--O 1.176 -2.804 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.871 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -53.19 -39.39 63.61 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 122.773 0.429 . . . . 0.0 110.419 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.15 -37.54 78.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -123.01 -2.31 8.7 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -171.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -150.2 -151.36 0.39 Allowed 'General case' 0 C--N 1.274 -2.698 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 -172.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.43 -163.71 1.08 Allowed 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 124.708 1.203 . . . . 0.0 111.868 -173.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.64 160.52 14.22 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . 0.406 ' O ' ' HG3' ' A' ' 481' ' ' MET . 4.0 t80 -41.74 132.2 3.01 Favored 'General case' 0 N--CA 1.415 -2.193 0 C-N-CA 126.816 2.046 . . . . 0.0 115.453 -179.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -116.83 159.15 22.79 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 171.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.4 pp -77.17 -18.91 14.37 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 CA-C-O 121.805 0.812 . . . . 0.0 108.819 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.499 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 8.0 m -57.14 -36.63 70.94 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.095 172.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -64.21 -38.34 90.69 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.343 0.592 . . . . 0.0 109.7 -179.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . 0.48 ' O ' HG12 ' A' ' 530' ' ' VAL . . . -60.95 -46.9 88.86 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.814 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.549 ' O ' HG21 ' A' ' 530' ' ' VAL . 82.7 t -61.95 -36.55 74.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 124.715 1.206 . . . . 0.0 111.444 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . 0.499 ' HG3' ' O ' ' A' ' 524' ' ' SER . 77.9 mt-30 -62.86 -36.08 82.08 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.651 0.739 . . . . 0.0 110.067 178.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.521 ' CG ' ' HD3' ' A' ' 536' ' ' ARG . 0.3 OUTLIER -76.15 -15.01 60.15 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.68 -176.755 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.549 HG21 ' O ' ' A' ' 527' ' ' VAL . 17.3 m -86.19 18.29 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 N-CA-C 116.037 1.865 . . . . 0.0 116.037 -170.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -96.99 -27.23 14.71 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 105.588 -2.005 . . . . 0.0 105.588 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 532' ' ' SER . . . . . 0.469 ' C ' ' H ' ' A' ' 534' ' ' GLU . 14.9 m -92.8 -142.33 0.21 Allowed 'General case' 0 C--N 1.292 -1.923 0 C-N-CA 128.871 2.868 . . . . 0.0 107.007 174.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . 0.512 ' C ' ' H ' ' A' ' 535' ' ' LEU . 13.4 m120 -29.08 28.08 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.851 1 C-N-CA 136.365 5.866 . . . . 0.0 117.559 173.161 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . 0.712 ' O ' ' HG3' ' A' ' 537' ' ' GLU . 10.4 pt-20 -33.28 2.27 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.633 0 C-N-CA 131.32 3.848 . . . . 0.0 116.348 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.512 ' H ' ' C ' ' A' ' 533' ' ' ASN . 3.1 pp -64.93 -17.19 64.14 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 162.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . 0.521 ' HD3' ' CG ' ' A' ' 529' ' ' TYR . 21.0 ttt180 -80.52 -11.99 59.59 Favored 'General case' 0 N--CA 1.402 -2.855 0 CA-C-N 113.149 -1.841 . . . . 0.0 111.288 174.274 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . 0.712 ' HG3' ' O ' ' A' ' 534' ' ' GLU . 0.1 OUTLIER -79.15 -32.35 44.3 Favored 'General case' 0 CA--C 1.475 -1.909 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 171.921 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 535' ' ' LEU . 62.4 m -59.54 -43.22 93.54 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 114.663 -1.153 . . . . 0.0 109.189 170.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 11.2 tp -56.75 -40.51 75.92 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.136 175.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' A' ' 527' ' ' VAL . 80.6 mt -61.17 -49.24 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 C-N-CA 122.81 0.444 . . . . 0.0 110.391 176.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.4 m -54.26 -43.23 70.8 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.854 0.835 . . . . 0.0 110.668 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 34.5 tp -72.75 -25.4 61.18 Favored 'General case' 0 CA--C 1.565 1.556 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.208 177.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -79.73 -28.09 40.54 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.717 1.207 . . . . 0.0 109.656 -178.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -68.45 -27.49 66.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.739 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -65.76 115.01 5.45 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.177 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . 0.429 ' ND2' ' HB2' ' A' ' 549' ' ' ASP . 58.1 t30 -109.06 82.56 1.61 Allowed 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.317 -174.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -84.48 -15.4 46.14 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.735 176.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -78.71 -3.1 42.53 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.443 -178.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . 0.429 ' HB2' ' ND2' ' A' ' 546' ' ' ASN . 19.0 t70 -62.57 -44.06 97.27 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.903 0.859 . . . . 0.0 109.187 176.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -85.34 156.87 59.51 Favored Pre-proline 0 C--N 1.291 -1.956 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -50.89 112.03 0.68 Allowed 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 122.277 1.984 . . . . 0.0 108.816 173.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -118.46 31.81 6.47 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.636 0.731 . . . . 0.0 110.109 -169.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -70.91 -6.09 35.75 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.677 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -66.34 -20.73 66.16 Favored 'General case' 0 C--O 1.214 -0.79 0 C-N-CA 124.984 1.314 . . . . 0.0 109.617 171.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -37.78 -54.29 1.24 Allowed 'General case' 0 C--O 1.204 -1.306 0 C-N-CA 123.798 0.839 . . . . 0.0 113.026 179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 20.5 mt -67.61 -42.64 86.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -176.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -56.06 -52.46 64.17 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.898 0.748 . . . . 0.0 110.121 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -65.03 -57.88 7.52 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.745 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.433 ' O ' HG13 ' A' ' 563' ' ' ILE . 74.9 t80 -50.99 -54.14 27.08 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 124.932 1.293 . . . . 0.0 112.615 -176.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.1 t -71.52 -40.65 72.0 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.386 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.594 -176.672 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -60.29 -34.82 74.3 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 117.959 0.345 . . . . 0.0 110.686 178.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.26 -36.5 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 121.383 0.611 . . . . 0.0 111.907 177.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 559' ' ' TYR . 60.2 mt -84.63 -36.5 11.62 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.01 0 CA-C-O 122.204 1.002 . . . . 0.0 108.328 -176.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -81.56 7.21 12.68 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.348 176.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -71.66 -20.3 61.97 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 172.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp . . . . . 0 CA--C 1.55 0.98 0 CA-C-N 113.925 -1.489 . . . . 0.0 107.383 172.327 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 7.1 mp . . . . . 0 N--CA 1.444 -0.773 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 18.4 m -71.06 135.58 47.82 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -174.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 19.6 mmt85 -60.12 -38.79 84.09 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 123.138 1.447 . . . . 0.0 107.199 173.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.475 ' HG3' ' HA ' ' A' ' 563' ' ' ILE . 18.3 mp0 -64.14 -21.76 66.67 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 112.768 -2.015 . . . . 0.0 111.555 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.658 ' O ' ' HG2' ' A' ' 474' ' ' ARG . 55.3 tt0 -66.28 -40.79 90.32 Favored 'General case' 0 C--O 1.209 -1.047 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -62.58 -41.53 99.0 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -58.17 -46.26 86.04 Favored 'General case' 0 C--O 1.243 0.738 0 O-C-N 123.675 0.609 . . . . 0.0 109.89 175.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -57.57 -50.29 73.59 Favored 'General case' 0 C--O 1.2 -1.548 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.957 175.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.658 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 18.7 mmm-85 -59.18 -32.0 69.51 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 120.77 0.319 . . . . 0.0 110.327 -178.108 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -66.02 -57.59 7.41 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . 0.402 ' HB3' ' HB2' ' A' ' 490' ' ' TYR . 1.4 m-85 -62.53 -35.4 79.31 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 178.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 25.8 tp -73.17 -9.0 58.25 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 124.941 1.296 . . . . 0.0 112.352 -176.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -46.51 -40.04 11.85 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.207 1.003 . . . . 0.0 113.577 -179.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . 0.512 ' HA ' HG22 ' A' ' 486' ' ' THR 0.256 0.3 OUTLIER 84.76 130.15 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 126.574 1.949 . . . . 0.0 111.753 -177.153 . . . . . . . . 4 4 . 1 . 017 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -93.42 -96.25 0.15 Allowed 'General case' 0 N--CA 1.427 -1.591 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.406 175.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 481' ' ' MET . . . . . . . . . . . . 0.398 0.5 OUTLIER -95.84 -91.37 0.22 Allowed 'General case' 0 CA--C 1.472 -2.04 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 179.905 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . 0.606 ' HB3' ' O ' ' A' ' 519' ' ' ASP . 12.6 mtm180 -79.04 -100.33 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.668 0 C-N-CA 116.689 -2.004 . . . . 0.0 111.202 -174.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.5 ' HB3' ' HB2' ' A' ' 519' ' ' ASP . 10.1 t70 -142.46 -54.72 0.43 Allowed 'General case' 0 C--N 1.296 -1.74 0 C-N-CA 123.453 0.701 . . . . 0.0 109.262 173.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 34.3 tttm -34.53 -66.45 0.17 Allowed 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 113.046 -1.888 . . . . 0.0 113.746 -170.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -58.95 -52.9 63.79 Favored 'General case' 0 C--O 1.202 -1.442 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.546 -173.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.512 HG22 ' HA ' ' A' ' 479' ' ' HIS . 93.8 m -61.03 -48.15 83.09 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.778 -177.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -54.92 -59.09 5.21 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 124.431 1.082 . . . . 0.0 108.959 -177.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 85.0 mt -68.65 -27.64 66.18 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.421 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -64.36 -30.8 71.83 Favored 'General case' 0 CA--C 1.489 -1.375 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . 0.435 ' O ' HG21 ' A' ' 494' ' ' VAL . 2.0 t80 -95.53 -53.43 3.74 Favored 'General case' 1 N--CA 1.367 -4.613 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 176.484 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -63.96 -40.24 95.95 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 124.747 1.219 . . . . 0.0 114.146 -167.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -81.93 -10.68 59.2 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.436 0.636 . . . . 0.0 112.17 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 17.8 m -84.84 -11.76 54.98 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.05 176.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 490' ' ' TYR . 23.9 t -113.72 109.39 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.863 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.256 -176.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -95.23 -17.1 22.0 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -89.56 20.61 3.86 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 113.329 -1.76 . . . . 0.0 111.647 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -58.51 -6.9 0.78 Allowed 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -174.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.57 -9.82 59.69 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 120.898 -1.126 . . . . 0.0 110.58 176.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -82.22 -9.41 59.51 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.783 176.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 20.4 p -56.14 160.91 2.66 Favored 'General case' 0 C--O 1.25 1.103 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -174.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.744 ' OD1' ' HB2' ' A' ' 503' ' ' HIS . 8.0 p30 -91.64 161.73 14.79 Favored 'General case' 0 N--CA 1.416 -2.145 0 CA-C-N 114.03 -1.441 . . . . 0.0 111.03 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -77.42 -23.31 50.62 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.571 0.7 . . . . 0.0 109.623 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . 0.744 ' HB2' ' OD1' ' A' ' 501' ' ' ASN . 32.3 m170 -61.42 -46.24 90.94 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 175.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . 0.429 ' CE1' ' CE1' ' A' ' 490' ' ' TYR . 72.2 t80 -57.65 -35.43 70.53 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.266 -1.334 . . . . 0.0 111.197 173.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -63.93 -48.85 74.94 Favored 'General case' 0 CA--C 1.482 -1.652 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -175.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.47 ' O ' HG21 ' A' ' 510' ' ' VAL . 0.2 OUTLIER -61.32 -37.67 84.09 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 118.283 -1.367 . . . . 0.0 110.17 -179.076 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . 0.45 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 23.3 t -66.85 -54.53 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 120.291 -0.563 . . . . 0.0 110.785 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -48.97 -39.87 28.23 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.849 0.86 . . . . 0.0 110.873 176.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -59.52 -56.34 23.2 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.362 1.065 . . . . 0.0 110.376 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.47 HG21 ' O ' ' A' ' 506' ' ' TYR . 2.5 t -64.44 -41.16 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.445 178.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 83.7 mt -58.75 -53.78 54.49 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.251 0.548 . . . . 0.0 111.488 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -62.82 -32.13 73.27 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.695 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.32 -40.98 98.12 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 120.773 0.321 . . . . 0.0 110.254 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . 0.442 ' CE2' HG12 ' A' ' 510' ' ' VAL . 33.4 m-85 -69.11 -57.09 5.86 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -49.03 -34.53 13.56 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.893 1.277 . . . . 0.0 111.307 -178.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.06 -23.97 66.63 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -112.38 -58.01 2.2 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.45 0.643 . . . . 0.0 110.021 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -158.01 121.54 4.01 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 125.345 1.458 . . . . 0.0 108.352 175.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . 0.606 ' O ' ' HB3' ' A' ' 482' ' ' ARG . 1.9 p30 -77.78 98.72 5.64 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-O 121.064 0.459 . . . . 0.0 111.698 -172.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -143.04 140.97 31.19 Favored 'General case' 0 CA--C 1.491 -1.315 0 O-C-N 121.437 -0.79 . . . . 0.0 110.938 167.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -85.0 105.9 16.1 Favored 'General case' 0 N--CA 1.402 -2.864 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 170.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -85.5 110.41 19.18 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -177.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 5.0 tt -55.85 -33.32 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 C-N-CA 124.58 1.152 . . . . 0.0 110.907 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.58 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 48.1 t -58.34 -38.64 77.56 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.083 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -65.26 -43.57 90.84 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . 0.448 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -58.11 -52.47 65.43 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.137 179.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.533 ' O ' HG22 ' A' ' 530' ' ' VAL . 8.9 p -67.77 -24.02 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 CA-C-O 121.063 0.459 . . . . 0.0 111.88 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . 0.58 ' HG3' ' O ' ' A' ' 524' ' ' SER . 26.2 mt-30 -67.65 -26.62 66.31 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 121.144 -0.972 . . . . 0.0 109.484 172.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.448 ' HB2' ' O ' ' A' ' 526' ' ' ALA . 47.5 m-85 -75.01 -0.49 19.0 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 118.136 -0.935 . . . . 0.0 112.659 174.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.642 ' HA ' ' NH1' ' A' ' 536' ' ' ARG . 32.3 m -72.37 20.88 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.532 3.666 0 N-CA-C 116.589 2.07 . . . . 0.0 116.589 -173.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -128.99 -40.5 1.5 Allowed 'General case' 0 C--N 1.278 -2.521 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 173.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.58 -144.62 0.03 OUTLIER 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 128.729 2.812 . . . . 0.0 112.062 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . 0.571 ' C ' ' H ' ' A' ' 535' ' ' LEU . 45.3 t30 -27.8 31.42 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 1 C-N-CA 138.496 6.719 . . . . 0.0 117.578 176.817 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -31.76 8.87 0.0 OUTLIER 'General case' 0 N--CA 1.536 3.854 0 C-N-CA 130.992 3.717 . . . . 0.0 117.045 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.571 ' H ' ' C ' ' A' ' 533' ' ' ASN . 45.5 mt -63.76 -26.84 68.82 Favored 'General case' 0 C--N 1.283 -2.295 0 N-CA-C 103.167 -2.901 . . . . 0.0 103.167 162.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . 0.642 ' NH1' ' HA ' ' A' ' 530' ' ' VAL . 1.4 ttp180 -56.27 -39.55 72.81 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 111.887 -2.415 . . . . 0.0 110.985 169.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -60.96 -47.04 88.28 Favored 'General case' 0 CA--C 1.481 -1.706 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 -179.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.471 ' O ' HD12 ' A' ' 542' ' ' LEU . 24.4 m -55.81 -48.15 75.91 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 114.295 -1.32 . . . . 0.0 109.832 174.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . 0.545 ' O ' ' HB2' ' A' ' 542' ' ' LEU . 9.3 tt -60.54 -36.71 79.09 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 536' ' ' ARG . 50.1 mm -66.88 -34.27 68.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 178.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 541' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' A' ' 538' ' ' THR . 29.7 t -57.32 -40.01 77.0 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.104 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 539' ' ' LEU . 6.3 mp -60.58 -33.63 73.0 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.527 0.731 . . . . 0.0 109.955 175.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -80.08 -31.11 39.36 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -69.71 -33.65 72.8 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -64.01 114.05 3.88 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.256 170.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -107.1 138.22 43.68 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.247 -175.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -79.8 9.5 5.15 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.288 1.042 . . . . 0.0 110.511 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -68.81 -41.41 78.69 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.703 -1.135 . . . . 0.0 108.542 174.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -68.36 -60.52 2.38 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.744 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -125.21 119.78 25.12 Favored Pre-proline 0 N--CA 1.425 -1.723 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . 0.471 ' HB2' ' OE1' ' A' ' 553' ' ' GLU . 29.9 Cg_endo -63.49 -169.91 0.1 Allowed 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.233 2.622 . . . . 0.0 114.065 -177.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . 0.443 ' O ' HG13 ' A' ' 556' ' ' ILE . 47.1 p90 -91.55 -13.65 31.68 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -170.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . 0.471 ' OE1' ' HB2' ' A' ' 551' ' ' PRO . 2.0 mp0 -66.9 -42.86 84.75 Favored 'General case' 0 C--N 1.28 -2.435 0 CA-C-O 121.304 0.573 . . . . 0.0 110.416 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -69.16 -24.07 64.03 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.551 175.121 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 551' ' ' PRO . 54.9 mt-10 -72.39 -46.78 53.72 Favored 'General case' 0 C--O 1.211 -0.927 0 C-N-CA 120.054 -0.658 . . . . 0.0 109.408 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 552' ' ' TYR . 64.8 mt -58.79 -49.17 83.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.116 0.566 . . . . 0.0 110.865 178.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -60.31 -52.53 64.88 Favored 'General case' 0 CA--C 1.508 -0.638 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.58 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -60.24 -43.35 96.17 Favored 'General case' 0 C--O 1.207 -1.161 0 O-C-N 123.862 0.726 . . . . 0.0 110.611 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.461 ' O ' HG13 ' A' ' 563' ' ' ILE . 50.4 t80 -54.43 -53.56 52.47 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 124.473 1.109 . . . . 0.0 110.813 176.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.9 t -65.21 -42.33 93.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.569 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -62.4 -42.43 99.42 Favored 'General case' 0 C--O 1.194 -1.861 0 C-N-CA 123.456 0.702 . . . . 0.0 110.087 -179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . 0.571 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 40.9 t -64.89 -41.21 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 CA-C-O 121.656 0.741 . . . . 0.0 112.679 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.475 ' HA ' ' HG3' ' A' ' 469' ' ' GLN . 54.1 mt -76.32 -35.85 28.3 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.224 0 CA-C-O 122.136 0.969 . . . . 0.0 109.462 -174.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -90.93 -6.82 53.58 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.0 -176.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 11.8 pt-20 -76.6 -25.03 53.48 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt . . . . . 0 C--N 1.322 -0.624 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.325 176.661 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 50.5 mt . . . . . 0 C--O 1.238 0.452 0 CA-C-O 121.027 0.441 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 68.8 p -75.05 178.64 5.51 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.125 -175.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . 0.463 ' NH2' HG22 ' A' ' 562' ' ' VAL . 8.1 ptm85 -60.18 -40.94 91.77 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.527 ' NE2' ' HA ' ' A' ' 563' ' ' ILE . 67.0 mt-30 -70.36 -30.02 66.84 Favored 'General case' 0 C--O 1.212 -0.88 0 C-N-CA 119.041 -1.064 . . . . 0.0 111.429 176.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.438 ' OE2' ' HB2' ' A' ' 501' ' ' ASN . 48.5 mt-10 -70.72 -35.19 72.61 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 120.777 0.323 . . . . 0.0 111.104 176.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.455 ' HD3' ' HA ' ' A' ' 471' ' ' LYS . 20.5 mmtp -66.93 -33.45 75.61 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.834 173.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.0 -47.17 60.35 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.91 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.44 -44.44 97.1 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 120.515 0.198 . . . . 0.0 110.617 176.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.487 ' NE ' ' HB3' ' A' ' 542' ' ' LEU . 11.7 tpt180 -54.88 -42.23 71.84 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.778 173.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . 0.414 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . . . -64.43 -44.93 89.64 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-O 120.799 0.333 . . . . 0.0 110.692 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.24 -18.69 64.78 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.2 mt -71.08 -15.96 62.55 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 121.953 -0.467 . . . . 0.0 112.07 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.518 ' HB2' ' HZ1' ' A' ' 478' ' ' LYS . 10.0 mtmp? -77.78 26.15 0.19 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 122.984 0.514 . . . . 0.0 111.747 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 -86.88 14.0 8.03 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 122.881 0.472 . . . . 0.0 111.959 -175.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 97.1 mt 71.35 -174.55 0.17 Allowed 'General case' 0 C--O 1.245 0.863 0 C-N-CA 123.754 0.821 . . . . 0.0 110.729 -177.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 59.0 ttp -88.26 -36.31 16.79 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.86 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 25.2 ttp180 -57.48 -46.67 83.43 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.914 1.286 . . . . 0.0 114.313 -173.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.3 59.29 0.27 Allowed 'General case' 0 C--N 1.28 -2.422 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -171.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -57.55 -36.76 72.06 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 124.319 1.047 . . . . 0.0 111.54 177.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -57.19 -44.05 83.24 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.117 0.484 . . . . 0.0 109.702 176.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 28.9 m -64.6 -31.63 72.93 Favored 'General case' 0 N--CA 1.421 -1.911 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.231 -178.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -61.03 -50.93 71.33 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . 0.463 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 76.1 mt -74.33 -36.75 63.68 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.514 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -61.32 -42.96 99.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.276 0.63 . . . . 0.0 112.431 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -78.57 -38.58 39.91 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.636 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -55.19 -49.28 72.31 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.82 178.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 12.6 pt-20 -79.29 -7.69 58.49 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -177.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 68.9 m -81.4 -14.88 56.65 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 122.121 0.962 . . . . 0.0 109.132 174.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . 0.463 HG11 ' HB2' ' A' ' 497' ' ' ASP . 33.1 t -100.08 133.78 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.376 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -149.5 -56.63 0.19 Allowed 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -88.46 -22.38 23.71 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 122.727 1.251 . . . . 0.0 108.347 178.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . 0.463 ' HB2' HG11 ' A' ' 494' ' ' VAL . 0.0 OUTLIER -72.96 -2.88 22.73 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 126.689 1.996 . . . . 0.0 109.365 178.191 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -77.68 22.51 0.26 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.147 0.979 . . . . 0.0 109.855 -176.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . 0.475 ' HE1' ' OE1' ' A' ' 469' ' ' GLN . 31.5 p90 -77.68 -9.75 59.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 500' ' ' THR . . . . . 0.405 HG22 ' CG ' ' A' ' 470' ' ' GLU . 1.1 p -54.48 166.97 0.37 Allowed 'General case' 0 N--CA 1.426 -1.661 0 C-N-CA 125.999 1.72 . . . . 0.0 115.115 -173.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.438 ' HB2' ' OE2' ' A' ' 470' ' ' GLU . 16.0 t-20 -64.38 146.99 53.57 Favored 'General case' 0 N--CA 1.429 -1.511 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.024 -175.042 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -64.05 -15.43 59.47 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-O 120.97 0.414 . . . . 0.0 111.306 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . 0.699 ' CE1' ' HG ' ' A' ' 535' ' ' LEU . 4.2 m-70 -65.54 -39.03 91.28 Favored 'General case' 0 C--O 1.203 -1.36 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.448 176.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -63.89 -36.62 84.54 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.508 0.67 . . . . 0.0 110.32 176.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -68.11 -41.33 81.91 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.783 176.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . 0.462 ' O ' HG22 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -60.81 -40.37 92.45 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.19 177.29 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . 0.469 ' O ' HD12 ' A' ' 511' ' ' LEU . 77.1 t -56.42 -56.47 13.48 Favored 'Isoleucine or valine' 0 C--N 1.341 0.217 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 173.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -45.62 -52.53 10.54 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 123.96 0.787 . . . . 0.0 111.747 174.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.47 -60.09 4.17 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 123.812 0.845 . . . . 0.0 112.539 -177.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 506' ' ' TYR . 17.0 t -60.78 -43.71 95.9 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 CA-C-O 120.512 0.196 . . . . 0.0 110.99 -176.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.469 HD12 ' O ' ' A' ' 507' ' ' VAL . 10.8 mp -63.32 -49.66 73.08 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.062 -178.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -64.18 -35.9 82.29 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 123.86 0.725 . . . . 0.0 110.856 -177.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -60.98 -44.28 97.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.822 0.344 . . . . 0.0 111.523 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -74.48 -47.21 34.64 Favored 'General case' 0 C--O 1.183 -2.409 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -47.83 -37.41 13.75 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 125.674 1.59 . . . . 0.0 110.777 -179.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.56 -40.09 88.84 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -115.87 -40.6 3.31 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -172.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -106.02 -151.57 0.46 Allowed 'General case' 0 C--N 1.271 -2.83 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . 0.428 ' CG ' ' H ' ' A' ' 520' ' ' GLN . 13.7 t70 -105.17 -160.11 0.74 Allowed 'General case' 0 C--N 1.285 -2.228 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -177.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . 0.428 ' H ' ' CG ' ' A' ' 519' ' ' ASP . 88.2 mt-30 -78.04 166.86 22.3 Favored 'General case' 0 C--N 1.296 -1.753 0 C-N-CA 123.164 0.585 . . . . 0.0 112.359 -174.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -90.07 134.38 34.29 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 125.314 1.445 . . . . 0.0 111.511 -172.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.14 176.24 5.4 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.105 177.455 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . 0.494 HD11 ' H ' ' A' ' 523' ' ' ILE 0.303 0.2 OUTLIER -78.95 -14.16 13.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 119.25 -0.98 . . . . 0.0 113.379 -175.859 . . . . . . . . 4 4 . 1 . 018 nuclear orig core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 40.9 m -60.37 -36.0 77.03 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 121.228 0.537 . . . . 0.0 109.589 169.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -66.03 -43.32 87.92 Favored 'General case' 0 C--O 1.253 1.286 0 CA-C-O 122.362 1.077 . . . . 0.0 108.207 176.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . 0.465 ' O ' ' HD3' ' A' ' 536' ' ' ARG . . . -56.15 -52.54 64.01 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 113.675 -1.602 . . . . 0.0 111.658 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.69 ' O ' HG12 ' A' ' 530' ' ' VAL . 8.0 p -64.46 -30.67 50.83 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.928 0 CA-C-O 120.546 0.212 . . . . 0.0 111.026 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 81.3 mm-40 -66.83 -22.94 65.99 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.404 -0.81 . . . . 0.0 110.474 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.14 -3.18 41.18 Favored 'General case' 0 N--CA 1.441 -0.916 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 174.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.69 HG12 ' O ' ' A' ' 527' ' ' VAL 0.267 8.9 p -74.67 53.84 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.553 0 CA-C-O 122.918 1.342 . . . . 0.0 113.267 179.039 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -107.16 -33.99 7.27 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 14.7 t -91.77 109.23 20.55 Favored 'General case' 0 N--CA 1.421 -1.893 0 N-CA-C 102.278 -3.23 . . . . 0.0 102.278 163.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 20.5 m120 -62.62 -68.2 0.35 Allowed 'General case' 0 C--O 1.203 -1.369 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 -170.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -37.44 23.71 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 114.398 1.259 . . . . 0.0 114.398 -177.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.699 ' HG ' ' CE1' ' A' ' 503' ' ' HIS . 6.6 tt -62.06 -68.01 0.36 Allowed 'General case' 0 C--O 1.266 1.928 0 C-N-CA 124.19 0.996 . . . . 0.0 109.897 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . 0.465 ' HD3' ' O ' ' A' ' 526' ' ' ALA . 3.7 tpm_? -69.86 -31.29 69.05 Favored 'General case' 0 N--CA 1.412 -2.33 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.843 -175.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -56.06 -58.34 8.35 Favored 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.9 0.75 . . . . 0.0 110.056 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 75.5 m -56.38 -49.04 75.58 Favored 'General case' 0 N--CA 1.443 -0.808 0 O-C-N 123.484 0.49 . . . . 0.0 111.018 178.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 20.1 tp -62.73 -32.81 74.0 Favored 'General case' 0 CA--C 1.568 1.648 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.837 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . 0.447 HG12 ' HE ' ' A' ' 536' ' ' ARG . 24.1 mm -68.39 -41.39 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 174.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 19.5 m -55.35 -48.65 73.91 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.593 0.711 . . . . 0.0 109.597 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.487 ' HB3' ' NE ' ' A' ' 474' ' ' ARG . 7.8 mp -66.5 -19.69 65.85 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.112 178.07 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -87.89 -35.34 17.78 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 122.766 0.426 . . . . 0.0 111.927 175.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -69.46 -40.51 77.1 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.163 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -72.06 115.92 11.85 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 121.552 0.691 . . . . 0.0 111.591 173.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -98.31 93.67 6.34 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.607 -172.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 6.6 mp -83.0 -17.22 44.15 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.775 177.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -77.16 9.17 3.25 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -176.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -69.84 -21.99 63.32 Favored 'General case' 0 CA--C 1.495 -1.149 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 168.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -88.11 121.49 70.5 Favored Pre-proline 0 N--CA 1.411 -2.395 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.02 105.54 0.17 Allowed 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.151 1.901 . . . . 0.0 108.623 173.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . 0.589 ' O ' HG13 ' A' ' 556' ' ' ILE . 4.2 p90 -77.25 40.11 0.26 Allowed 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 -168.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.82 -48.04 64.56 Favored 'General case' 0 C--N 1.266 -3.046 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.603 -179.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -69.07 -27.22 65.43 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . 0.499 ' HB3' ' HB2' ' A' ' 552' ' ' TYR . 29.6 tt0 -68.85 -38.39 79.76 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.237 -177.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . 0.589 HG13 ' O ' ' A' ' 552' ' ' TYR . 62.5 mt -64.52 -45.57 95.26 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.332 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 176.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -59.57 -43.24 93.67 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 120.887 0.375 . . . . 0.0 110.686 178.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . 0.566 ' O ' HG21 ' A' ' 562' ' ' VAL . 27.5 t70 -62.54 -55.24 29.2 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.812 175.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.419 ' O ' HG12 ' A' ' 563' ' ' ILE . 40.6 t80 -48.28 -53.02 18.73 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 125.426 1.49 . . . . 0.0 110.759 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 48.6 t -55.99 -50.98 66.32 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.798 0 O-C-N 124.04 0.837 . . . . 0.0 109.524 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . 0.523 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 3.8 t-20 -57.95 -42.77 85.64 Favored 'General case' 0 C--O 1.193 -1.915 0 CA-C-N 117.788 0.267 . . . . 0.0 110.812 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . 0.566 HG21 ' O ' ' A' ' 558' ' ' ASP . 99.1 t -62.47 -36.39 74.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 C-N-CA 124.031 0.933 . . . . 0.0 112.403 -178.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.527 ' HA ' ' NE2' ' A' ' 469' ' ' GLN . 50.8 mm -88.08 -41.86 14.58 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.929 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 -173.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -85.38 18.02 2.88 Favored 'General case' 0 N--CA 1.423 -1.789 0 CA-C-N 112.946 -1.934 . . . . 0.0 110.274 -176.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 51.6 mt-10 -72.65 -16.05 61.71 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.199 -2.149 . . . . 0.0 105.199 165.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . 0.439 ' HZ3' ' CD ' ' A' ' 469' ' ' GLN . 59.8 mttp . . . . . 0 CA--C 1.543 0.683 0 CA-C-N 113.444 -1.707 . . . . 0.0 109.942 174.088 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 84.0 mt . . . . . 0 N--CA 1.426 -1.649 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 12.9 m -60.75 176.65 0.37 Allowed 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -170.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -54.73 -17.63 3.69 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.684 1.993 . . . . 0.0 113.214 -175.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -53.07 -44.84 67.8 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 123.188 0.305 . . . . 0.0 110.986 177.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . 0.5 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 38.1 tt0 -66.31 -30.76 71.24 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 119.511 -0.876 . . . . 0.0 111.046 -178.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . 0.417 ' HD3' HH21 ' A' ' 474' ' ' ARG . 27.8 tptp -64.62 -33.01 74.93 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.591 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -67.8 -44.86 76.37 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . 0.427 ' HB3' ' CE2' ' A' ' 504' ' ' PHE . 1.4 mp0 -56.64 -46.16 81.16 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.074 0.464 . . . . 0.0 110.529 172.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 37.7 mtm-85 -62.81 -37.7 87.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.384 -179.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . 0.641 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -72.13 -39.2 69.0 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 120.87 0.367 . . . . 0.0 110.927 176.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -63.56 -39.51 94.59 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-O 121.682 0.753 . . . . 0.0 110.797 -179.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 25.2 tp -71.78 -17.44 62.18 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.788 -1.096 . . . . 0.0 113.67 -173.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.641 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 19.5 pttp -70.78 -11.11 60.75 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -177.009 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -122.93 90.79 3.36 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . 0.497 ' HA ' ' HB2' ' A' ' 483' ' ' ASP . 4.2 tt -143.02 71.22 1.33 Allowed 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.781 0.8 . . . . 0.0 109.266 177.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 65.0 mtt -97.15 -88.73 0.29 Allowed 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.561 177.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -72.31 -9.06 58.0 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.276 1.431 . . . . 0.0 109.616 174.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.549 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 5.5 m-20 -69.18 37.48 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 128.411 2.685 . . . . 0.0 116.136 -166.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -53.41 -40.13 64.86 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 121.704 0.764 . . . . 0.0 109.983 172.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -60.0 -49.77 76.38 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.681 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 486' ' ' THR . . . . . 0.549 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 7.1 m -59.95 -42.18 93.47 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.101 0.96 . . . . 0.0 110.773 -178.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -54.79 -51.32 66.12 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 81.1 mt -68.68 -29.7 68.2 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.4 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -68.97 -34.26 75.02 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.778 0.323 . . . . 0.0 111.134 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -85.27 -40.14 16.93 Favored 'General case' 0 N--CA 1.419 -2.014 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -67.8 -35.15 78.13 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -77.48 -21.9 52.13 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 120.871 0.367 . . . . 0.0 110.525 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 64.5 m -83.8 -8.6 59.19 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.32 0.581 . . . . 0.0 111.76 -175.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . 0.405 HG23 ' OD1' ' A' ' 498' ' ' ASN . 0.3 OUTLIER -92.97 153.44 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.638 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -176.642 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -155.26 -105.69 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -172.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . 0.47 ' C ' ' H ' ' A' ' 498' ' ' ASN . 38.8 ttpt -90.3 -37.88 13.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.453 0.644 . . . . 0.0 110.533 178.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . 0.472 ' C ' ' H ' ' A' ' 499' ' ' PHE . 20.0 t0 -75.28 30.84 0.1 Allowed 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 126.04 1.736 . . . . 0.0 112.322 -174.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . 0.47 ' H ' ' C ' ' A' ' 496' ' ' LYS . 6.0 m-20 -73.14 36.11 0.08 Allowed 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 126.779 2.032 . . . . 0.0 111.355 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . 0.472 ' H ' ' C ' ' A' ' 497' ' ' ASP . 8.3 p90 -65.79 -13.06 58.72 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.258 -178.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 15.9 m -55.15 149.84 11.73 Favored 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 124.418 1.087 . . . . 0.0 108.743 173.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.469 ' C ' ' H ' ' A' ' 503' ' ' HIS . 49.8 m-80 -65.58 155.23 36.42 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.615 -0.678 . . . . 0.0 112.032 -174.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -66.64 5.92 0.54 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.135 0.493 . . . . 0.0 111.894 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . 0.473 ' O ' HG22 ' A' ' 507' ' ' VAL . 1.5 m-70 -54.51 -51.78 64.04 Favored 'General case' 0 C--O 1.203 -1.353 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 172.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . 0.427 ' CE2' ' HB3' ' A' ' 473' ' ' GLU . 94.2 m-85 -65.15 -27.3 68.63 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.967 -1.015 . . . . 0.0 113.182 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -68.14 -44.23 76.5 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -38.5 89.13 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 119.787 -0.765 . . . . 0.0 109.677 177.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . 0.473 HG22 ' O ' ' A' ' 503' ' ' HIS . 22.1 t -62.18 -47.11 94.66 Favored 'Isoleucine or valine' 0 C--N 1.354 0.778 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -47.78 -45.72 29.67 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.697 0.799 . . . . 0.0 111.235 173.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -60.05 -53.19 60.71 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.445 -179.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 18.5 t -58.87 -48.1 87.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 123.406 0.442 . . . . 0.0 109.945 178.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 97.1 mt -54.46 -56.53 17.78 Favored 'General case' 0 C--O 1.211 -0.971 0 O-C-N 124.067 0.854 . . . . 0.0 110.545 -178.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -60.3 -30.96 69.83 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 123.996 0.918 . . . . 0.0 110.774 -177.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.49 -46.66 66.09 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.597 -178.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . 0.251 11.2 p90 -82.83 -28.61 30.05 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 119.399 -0.92 . . . . 0.0 111.049 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -51.71 -35.67 43.9 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.802 1.241 . . . . 0.0 108.779 174.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -59.47 -28.83 67.35 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.036 -0.983 . . . . 0.0 111.234 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -103.36 -59.57 1.69 Allowed 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.485 179.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -157.38 122.18 4.43 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -90.87 96.95 10.89 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -174.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -142.27 124.23 15.29 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 161.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -67.97 129.24 39.31 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 119.45 1.023 . . . . 0.0 110.497 179.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -113.35 132.24 55.66 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.405 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 35.4 pt -78.47 -13.03 13.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.186 0 CA-C-O 121.17 0.51 . . . . 0.0 110.484 -177.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 524' ' ' SER . . . . . 0.55 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 33.1 t -58.17 -41.01 82.92 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.373 174.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -65.55 -35.86 82.08 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 108.901 -0.778 . . . . 0.0 108.901 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -60.71 -50.32 73.94 Favored 'General case' 0 C--O 1.213 -0.833 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.311 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 11.9 p -71.17 -18.02 20.27 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.868 -0.52 . . . . 0.0 111.006 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.4 mm100 -68.04 -39.78 83.0 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 170.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.508 ' CB ' ' HG3' ' A' ' 536' ' ' ARG . 8.1 m-85 -72.36 13.9 0.29 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.146 1.378 . . . . 0.0 112.894 176.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.77 ' HA ' ' NH2' ' A' ' 536' ' ' ARG . 8.7 p -72.74 18.4 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.592 2.585 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -129.16 -49.27 1.2 Allowed 'General case' 0 N--CA 1.479 0.991 0 O-C-N 120.953 -1.092 . . . . 0.0 109.714 176.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 532' ' ' SER . . . . . 0.429 ' C ' ' H ' ' A' ' 534' ' ' GLU . 27.4 t -76.04 -144.42 0.02 OUTLIER 'General case' 0 CA--C 1.578 2.036 0 C-N-CA 126.806 2.042 . . . . 0.0 112.349 -176.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . 0.583 ' C ' ' H ' ' A' ' 535' ' ' LEU . 2.0 t-20 -28.45 30.42 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.978 1 C-N-CA 138.831 6.853 . . . . 0.0 117.419 179.072 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . 0.429 ' H ' ' C ' ' A' ' 532' ' ' SER . 12.6 pt-20 -32.32 9.92 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.221 1 C-N-CA 131.762 4.025 . . . . 0.0 116.891 179.706 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.583 ' H ' ' C ' ' A' ' 533' ' ' ASN . 40.9 mt -63.51 -29.36 70.64 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 102.474 -3.158 . . . . 0.0 102.474 162.051 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . 0.77 ' NH2' ' HA ' ' A' ' 530' ' ' VAL . 0.4 OUTLIER -54.27 -36.92 64.13 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 111.897 -2.411 . . . . 0.0 110.279 170.617 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -72.22 -37.24 69.24 Favored 'General case' 0 CA--C 1.483 -1.611 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -175.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 5.9 m -59.64 -40.98 89.44 Favored 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 118.837 -1.145 . . . . 0.0 108.965 170.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 63.8 tp -59.99 -34.51 73.42 Favored 'General case' 0 C--O 1.215 -0.734 0 O-C-N 121.619 -0.676 . . . . 0.0 111.676 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 53.0 mt -61.97 -35.12 66.49 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 5.5 p -58.3 -43.96 88.34 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 8.2 mp -64.78 -41.15 96.07 Favored 'General case' 0 N--CA 1.487 1.42 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.175 176.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -61.97 -35.42 78.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.173 0.989 . . . . 0.0 108.85 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . 0.567 ' HG2' ' O ' ' A' ' 544' ' ' GLN . 53.4 tt0 -74.05 39.97 0.12 Allowed 'General case' 0 CA--C 1.567 1.606 0 CA-C-O 122.656 1.217 . . . . 0.0 111.209 177.066 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -75.05 157.08 35.41 Favored 'General case' 0 C--N 1.279 -2.47 0 O-C-N 120.949 -1.095 . . . . 0.0 111.086 177.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -102.73 -178.01 3.55 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.717 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . 0.599 ' O ' ' HG3' ' A' ' 550' ' ' GLU . 92.2 mt -76.27 18.96 0.26 Allowed 'General case' 0 C--O 1.208 -1.111 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -173.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . 0.484 ' O ' ' HD2' ' A' ' 552' ' ' TYR . 31.3 p-10 -75.02 -8.5 56.71 Favored 'General case' 0 C--N 1.317 -0.836 0 O-C-N 121.934 -0.479 . . . . 0.0 110.974 179.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -70.15 0.86 5.45 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.927 0.891 . . . . 0.0 112.35 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . 0.599 ' HG3' ' O ' ' A' ' 547' ' ' LEU . 45.8 mt-10 -55.08 133.35 68.29 Favored Pre-proline 0 C--O 1.239 0.544 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_exo 5.16 61.01 0.0 OUTLIER 'Trans proline' 0 C--N 1.376 1.994 1 C-N-CA 126.843 5.029 . . . . 0.0 115.878 -166.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . 0.601 ' O ' ' HG3' ' A' ' 555' ' ' GLU . 1.6 t80 -99.83 21.17 12.94 Favored 'General case' 0 C--O 1.205 -1.248 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 -175.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -68.35 11.1 0.18 Allowed 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -174.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . 0.552 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 6.9 t30 -75.18 -20.6 59.23 Favored 'General case' 0 C--O 1.17 -3.098 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 171.184 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . 0.601 ' HG3' ' O ' ' A' ' 552' ' ' TYR . 51.3 mt-10 -35.49 -46.04 0.37 Allowed 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 114.517 1.302 . . . . 0.0 114.517 -176.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 59.5 mt -58.78 -38.48 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 CA-C-N 118.28 0.491 . . . . 0.0 110.714 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . 0.552 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 3.4 t70 -59.54 -54.59 44.76 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.984 0.914 . . . . 0.0 108.808 176.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . 0.61 ' O ' HG22 ' A' ' 562' ' ' VAL . 12.8 m-20 -58.52 -53.92 52.83 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.006 177.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.538 ' O ' HD11 ' A' ' 563' ' ' ILE . 63.3 t80 -51.86 -53.28 42.27 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 126.815 2.046 . . . . 0.0 111.881 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 49.3 t -59.84 -41.39 85.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . 0.593 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 8.0 t30 -60.89 -59.73 4.92 Favored 'General case' 0 C--O 1.193 -1.906 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.558 175.227 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . 0.61 HG22 ' O ' ' A' ' 558' ' ' ASP . 60.1 t -55.07 -36.98 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 C-N-CA 124.074 0.949 . . . . 0.0 112.714 -172.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.538 HD11 ' O ' ' A' ' 559' ' ' TYR . 1.6 mp -80.15 -40.61 20.35 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.544 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.917 -172.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -95.45 7.09 47.25 Favored 'General case' 0 N--CA 1.416 -2.167 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.869 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.593 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 52.5 mt-10 -71.67 -23.68 61.71 Favored 'General case' 0 C--N 1.368 1.391 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 170.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 62.5 tttm . . . . . 0 CA--C 1.557 1.224 0 CA-C-N 113.902 -1.499 . . . . 0.0 114.324 -176.453 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 92.2 mt . . . . . 0 N--CA 1.432 -1.332 0 CA-C-O 121.36 0.6 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 39.7 m -101.76 127.86 48.35 Favored 'General case' 0 C--N 1.278 -2.502 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 88.4 mtm180 -62.74 -12.77 26.11 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -177.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 469' ' ' GLN . . . . . 0.471 ' O ' ' HG3' ' A' ' 473' ' ' GLU . 24.6 mt-30 -40.99 -49.55 3.29 Favored 'General case' 0 C--O 1.206 -1.185 0 C-N-CA 125.479 1.511 . . . . 0.0 114.156 -177.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -68.74 -31.81 71.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.953 0.406 . . . . 0.0 111.039 -174.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 22.8 tptp -74.76 -29.81 61.26 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 472' ' ' ALA . . . . . 0.467 ' HB1' ' CD1' ' A' ' 559' ' ' TYR . . . -69.82 -47.92 60.97 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 174.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . 0.476 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 57.7 mt-10 -49.81 -49.57 48.32 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.64 0.776 . . . . 0.0 109.488 173.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 474' ' ' ARG . . . . . 0.515 ' HG3' ' CD2' ' A' ' 542' ' ' LEU . 11.1 tpp85 -46.79 -60.89 2.12 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 125.261 1.424 . . . . 0.0 109.657 -178.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 475' ' ' ALA . . . . . 0.543 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -68.53 -36.01 78.26 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-N 115.289 -0.868 . . . . 0.0 112.445 -177.132 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -33.54 74.69 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.332 0.586 . . . . 0.0 112.079 -177.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 477' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 94.0 mt -73.47 -8.84 57.57 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -176.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 478' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 63.3 pttt -76.5 6.38 5.86 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.917 -0.49 . . . . 0.0 110.993 -178.133 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 10.4 t-80 -77.75 23.94 0.23 Allowed 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 123.741 0.816 . . . . 0.0 112.729 -172.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . 0.29 2.7 pp 49.76 -158.8 0.07 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.629 1.572 . . . . 0.0 114.798 177.165 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 481' ' ' MET . . . . . 0.479 ' C ' ' H ' ' A' ' 483' ' ' ASP . 46.9 ttm -66.7 6.95 0.41 Allowed 'General case' 0 CA--C 1.569 1.695 0 CA-C-O 122.569 1.175 . . . . 0.0 113.648 -174.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -74.69 11.1 1.12 Allowed 'General case' 0 C--O 1.248 0.998 0 C-N-CA 123.899 0.88 . . . . 0.0 110.153 167.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 483' ' ' ASP . . . . . 0.479 ' H ' ' C ' ' A' ' 481' ' ' MET . 9.5 p-10 -68.81 1.0 3.65 Favored 'General case' 0 C--O 1.201 -1.478 0 C-N-CA 126.231 1.812 . . . . 0.0 113.608 -169.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -72.28 -60.37 2.26 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.54 -53.52 56.59 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.544 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 86.1 m -59.44 -37.97 79.49 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.786 -178.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -56.15 -58.02 9.73 Favored 'General case' 0 C--O 1.205 -1.269 0 C-N-CA 120.419 -0.513 . . . . 0.0 110.158 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 5.9 mp -72.29 -31.91 66.13 Favored 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 119.454 -0.898 . . . . 0.0 111.364 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -68.26 -41.06 81.67 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.932 0.396 . . . . 0.0 111.32 -177.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -85.28 -35.41 21.53 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.546 -178.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -58.26 -46.36 86.15 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 122.873 0.469 . . . . 0.0 112.259 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -81.65 -15.58 54.12 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -177.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 73.4 m -80.98 -28.42 35.56 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -178.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 11.8 t -98.52 152.3 4.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -152.23 -39.58 0.11 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.693 0.759 . . . . 0.0 110.27 -178.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -82.44 18.7 1.4 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.938 178.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 497' ' ' ASP . . . . . 0.729 ' O ' ' HB3' ' A' ' 501' ' ' ASN . 7.6 p-10 -65.93 -19.51 65.89 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 123.837 0.855 . . . . 0.0 110.78 -178.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . 0.458 ' HA ' ' ND2' ' A' ' 501' ' ' ASN . 6.9 t-20 -72.88 15.45 0.2 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.751 1.22 . . . . 0.0 114.023 -165.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -75.65 -71.95 0.34 Allowed 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 26.0 m -127.36 93.36 3.71 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 170.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 501' ' ' ASN . . . . . 0.729 ' HB3' ' O ' ' A' ' 497' ' ' ASP . 34.8 p-10 -127.14 46.33 2.54 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -169.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 18.3 pm0 -73.17 -25.29 60.74 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.319 -0.952 . . . . 0.0 108.485 173.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 503' ' ' HIS . . . . . 0.418 ' O ' HG22 ' A' ' 507' ' ' VAL . 38.3 t-80 -62.64 -64.49 0.9 Allowed 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.218 175.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -55.74 -38.48 69.85 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 124.025 0.93 . . . . 0.0 110.639 -179.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -64.88 -52.02 58.82 Favored 'General case' 0 CA--C 1.5 -0.943 0 C-N-CA 123.079 0.552 . . . . 0.0 109.595 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -62.61 -41.67 99.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 507' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 503' ' ' HIS . 67.0 t -62.36 -52.96 53.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.714 178.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -49.64 -53.06 26.41 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 124.534 1.146 . . . . 0.0 111.838 176.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -56.79 -62.63 1.6 Allowed 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.321 0.648 . . . . 0.0 112.185 -177.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 48.6 t -59.69 -45.85 93.98 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.665 0 O-C-N 123.692 0.62 . . . . 0.0 110.944 -176.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 3.2 tt -69.23 -49.08 59.66 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.955 -172.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -67.76 -29.52 68.75 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.185 -176.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -64.43 -49.23 72.33 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.244 0.545 . . . . 0.0 110.434 178.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -70.48 -55.25 9.4 Favored 'General case' 0 C--O 1.198 -1.627 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.232 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -52.67 -36.32 56.74 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -178.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -77.6 -19.38 55.67 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.34 -45.6 2.92 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 122.111 0.958 . . . . 0.0 110.018 -172.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 39.0 t-20 -112.38 -154.34 0.54 Allowed 'General case' 0 C--N 1.286 -2.169 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -83.82 -160.24 0.43 Allowed 'General case' 0 C--N 1.308 -1.221 0 C-N-CA 123.468 0.707 . . . . 0.0 109.878 177.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 520' ' ' GLN . . . . . 0.474 ' H ' ' NE2' ' A' ' 520' ' ' GLN . 0.0 OUTLIER -62.62 177.12 0.56 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.617 0.767 . . . . 0.0 110.257 178.265 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -88.11 148.81 24.27 Favored 'General case' 1 N--CA 1.37 -4.449 0 O-C-N 121.543 -0.723 . . . . 0.0 109.638 -175.242 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 522' ' ' ASN . . . . . 0.482 ' HB3' ' OD2' ' A' ' 525' ' ' ASP . 52.0 t30 -116.11 154.64 29.6 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.466 0.65 . . . . 0.0 111.313 -174.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -37.21 78.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 C-N-CA 124.776 1.23 . . . . 0.0 110.7 -178.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 39.0 t -57.1 -33.01 66.88 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.956 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 525' ' ' ASP . . . . . 0.482 ' OD2' ' HB3' ' A' ' 522' ' ' ASN . 12.0 m-20 -61.1 -40.69 94.7 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.303 0.573 . . . . 0.0 110.0 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 526' ' ' ALA . . . . . 0.433 ' HA ' ' HD3' ' A' ' 536' ' ' ARG . . . -63.57 -43.17 97.79 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.243 178.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 527' ' ' VAL . . . . . 0.504 ' O ' HG21 ' A' ' 530' ' ' VAL . 96.9 t -64.63 -35.34 74.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 C-N-CA 125.033 1.333 . . . . 0.0 110.805 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -66.74 -34.63 78.26 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.43 0.634 . . . . 0.0 109.595 175.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.51 ' HB3' ' HD2' ' A' ' 536' ' ' ARG . 1.1 t80 -77.28 2.62 15.11 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 -178.735 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 530' ' ' VAL . . . . . 0.504 HG21 ' O ' ' A' ' 527' ' ' VAL . 14.7 m -74.69 15.0 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -176.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -109.03 -36.22 6.13 Favored 'General case' 0 C--N 1.285 -2.228 0 C-N-CA 119.458 -0.897 . . . . 0.0 108.644 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 532' ' ' SER . . . . . 0.557 ' C ' ' H ' ' A' ' 534' ' ' GLU . 26.3 t -81.44 -143.16 0.05 OUTLIER 'General case' 0 C--N 1.29 -2.019 0 C-N-CA 125.63 1.572 . . . . 0.0 107.673 173.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 533' ' ' ASN . . . . . 0.571 ' C ' ' H ' ' A' ' 535' ' ' LEU 0.386 17.2 m120 -35.14 29.08 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.986 1 C-N-CA 132.926 4.49 . . . . 0.0 118.764 171.607 . . . . . . . . 4 3 . 1 . 020 nuclear orig core ' A' A ' 534' ' ' GLU . . . . . 0.557 ' H ' ' C ' ' A' ' 532' ' ' SER . 9.6 pt-20 -34.63 8.04 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 130.515 3.526 . . . . 0.0 116.008 177.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 535' ' ' LEU . . . . . 0.571 ' H ' ' C ' ' A' ' 533' ' ' ASN . 3.3 pp -67.77 -21.36 65.26 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 162.179 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 536' ' ' ARG . . . . . 0.51 ' HD2' ' HB3' ' A' ' 529' ' ' TYR . 28.0 ttm-85 -66.56 -24.86 66.42 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.676 -1.602 . . . . 0.0 110.445 171.191 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -75.34 -39.2 59.63 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 538' ' ' THR . . . . . 0.431 ' O ' ' HB2' ' A' ' 541' ' ' SER . 8.9 m -57.7 -42.23 83.29 Favored 'General case' 0 CA--C 1.563 1.48 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.45 173.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.07 -43.09 91.71 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.031 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 540' ' ' ILE . . . . . 0.52 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 75.2 mt -57.29 -40.51 74.35 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.256 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 541' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 538' ' ' THR . 26.4 m -56.31 -38.79 71.75 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 120.934 0.397 . . . . 0.0 111.339 177.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 542' ' ' LEU . . . . . 0.555 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 8.3 mp -69.59 -24.8 63.73 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 120.801 0.334 . . . . 0.0 111.644 174.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -75.44 -38.64 59.6 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 544' ' ' GLN . . . . . 0.52 ' HG2' ' O ' ' A' ' 540' ' ' ILE . 74.7 mm-40 -79.5 33.63 0.25 Allowed 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 125.763 1.625 . . . . 0.0 110.481 177.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 545' ' ' TYR . . . . . 0.555 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 8.6 p90 -65.12 154.49 37.76 Favored 'General case' 0 N--CA 1.404 -2.77 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -169.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 546' ' ' ASN . . . . . 0.431 ' C ' ' H ' ' A' ' 548' ' ' ASN . 15.4 t-20 -83.6 -176.19 6.18 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.497 -1.228 . . . . 0.0 109.017 -174.342 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 547' ' ' LEU . . . . . 0.458 ' C ' ' H ' ' A' ' 549' ' ' ASP . 2.2 pp -69.45 17.54 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -174.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 548' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 546' ' ' ASN . 15.8 m120 -73.96 22.43 0.09 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.251 1.821 . . . . 0.0 111.782 177.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 549' ' ' ASP . . . . . 0.458 ' H ' ' C ' ' A' ' 547' ' ' LEU . 28.5 t70 -72.12 -6.79 45.05 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 124.008 0.923 . . . . 0.0 112.19 -177.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.43 158.91 18.6 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-O 119.313 -0.375 . . . . 0.0 110.266 -177.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -59.7 72.99 0.06 OUTLIER 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 122.86 2.373 . . . . 0.0 115.105 -179.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -100.67 9.7 42.11 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 173.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.35 14.2 0.1 Allowed 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 113.408 -1.724 . . . . 0.0 113.934 -174.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 554' ' ' ASN . . . . . 0.544 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 3.9 t30 -68.5 -19.98 64.56 Favored 'General case' 0 C--O 1.192 -1.953 0 N-CA-C 104.12 -2.548 . . . . 0.0 104.12 165.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -33.46 -42.06 0.09 Allowed 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 127.528 2.331 . . . . 0.0 111.783 168.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 21.9 mm -62.02 -44.3 98.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 109.425 -0.584 . . . . 0.0 109.425 177.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 557' ' ' ASP . . . . . 0.544 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 6.4 t70 -58.64 -44.11 89.96 Favored 'General case' 0 C--O 1.25 1.112 0 C-N-CA 124.261 1.024 . . . . 0.0 110.443 176.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -68.91 -49.21 60.08 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.325 177.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 559' ' ' TYR . . . . . 0.467 ' CD1' ' HB1' ' A' ' 472' ' ' ALA . 48.4 t80 -50.25 -52.06 39.38 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.164 1.386 . . . . 0.0 111.356 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 48.4 t -62.96 -39.18 84.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.213 -179.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -61.45 -36.5 80.58 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-O 120.705 0.288 . . . . 0.0 110.514 175.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 562' ' ' VAL . . . . . 0.516 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 54.0 t -70.63 -33.75 54.3 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.05 0 C-N-CA 123.863 0.865 . . . . 0.0 112.905 177.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 563' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 559' ' ' TYR . 49.1 mm -84.17 -40.1 15.25 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.717 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 -176.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -79.39 -2.97 44.17 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 114.449 -1.25 . . . . 0.0 110.164 178.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 565' ' ' GLU . . . . . 0.516 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 19.1 tt0 -56.55 -35.08 67.73 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 170.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 19.9 mmtp . . . . . 0 N--CA 1.439 -1.013 0 CA-C-N 113.927 -1.488 . . . . 0.0 109.885 179.065 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 . . . . . 0 C--O 1.251 1.14 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -92.15 101.66 14.18 Favored 'General case' 0 N--CA 1.418 -2.032 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 173.49 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -114.15 56.6 0.71 Allowed 'General case' 0 C--N 1.292 -1.928 0 C-N-CA 119.943 -0.703 . . . . 0.0 109.48 -174.662 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 89.0 mt -66.6 98.08 0.49 Allowed 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 170.54 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' SER . . . . . 0.44 ' HB3' ' OE1' ' A' ' 470' ' ' GLU . 33.0 t -85.46 174.66 9.34 Favored 'General case' 0 C--N 1.272 -2.795 0 CA-C-N 114.461 -1.245 . . . . 0.0 111.889 -171.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 10.0 ptm85 -65.5 -22.86 66.77 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.611 -1.631 . . . . 0.0 110.744 176.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.414 HE21 HG21 ' A' ' 563' ' ' ILE . 51.0 mt-30 -67.27 -34.35 77.24 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 177.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.446 ' HG2' ' ND2' ' A' ' 501' ' ' ASN . 2.3 mp0 -73.86 -23.2 59.58 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.509 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.02 -33.38 70.3 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 106.168 -1.79 . . . . 0.0 106.168 174.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . 0.405 ' HB2' ' O ' ' A' ' 469' ' ' GLN . . . -67.25 -42.29 84.16 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.492 174.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.7 -60.62 2.96 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 122.37 1.081 . . . . 0.0 109.257 172.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 55.2 mtt180 -52.83 -46.34 67.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 113.66 -1.609 . . . . 0.0 112.466 -178.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -70.89 -36.82 72.92 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -62.95 -29.84 71.11 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 121.577 0.703 . . . . 0.0 110.57 -178.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 91.5 mt -73.23 -7.33 51.0 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.968 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -77.17 -13.67 59.91 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 176.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 54.8 t60 -60.66 137.74 58.15 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 63.2 mt -51.52 123.35 9.67 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-O 122.126 0.965 . . . . 0.0 112.573 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 52.4 mtt -71.74 1.26 7.12 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.286 -1.779 . . . . 0.0 113.502 -170.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -68.08 -44.65 75.82 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 171.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.417 ' CG ' ' HG1' ' A' ' 486' ' ' THR . 48.6 t0 -74.7 58.78 0.82 Allowed 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 126.485 1.914 . . . . 0.0 111.879 -174.153 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . 0.475 ' HE3' HD22 ' A' ' 511' ' ' LEU . 12.5 mmmm -62.14 -18.01 59.59 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.965 -1.016 . . . . 0.0 113.346 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -57.46 -39.85 77.23 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 171.805 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.417 ' HG1' ' CG ' ' A' ' 483' ' ' ASP . 19.8 m -60.17 -35.01 74.39 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.843 177.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . 0.454 ' CE1' ' HA ' ' A' ' 508' ' ' PHE . 4.9 t80 -58.62 -51.98 67.61 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-O 121.122 0.487 . . . . 0.0 110.078 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 53.9 tp -70.57 -31.48 68.53 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.809 -176.518 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -69.5 -42.11 75.2 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.007 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.66 -31.43 57.31 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -178.208 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -60.39 -51.1 70.91 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.45 176.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -85.29 -12.11 53.14 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 45.8 m -87.41 -15.16 38.57 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.634 0.731 . . . . 0.0 109.527 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 1.4 p -99.45 176.52 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.415 -2.216 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.01 -175.678 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -85.01 100.71 11.85 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.469 0.652 . . . . 0.0 111.811 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -65.5 -30.46 71.23 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.486 178.708 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.8 -72.04 0.21 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.67 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -92.12 -33.43 14.76 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -78.64 -7.59 57.79 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.956 -171.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.3 t -60.73 108.33 0.83 Allowed 'General case' 0 CA--C 1.563 1.445 0 CA-C-O 123.299 1.523 . . . . 0.0 111.235 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.446 ' ND2' ' HG2' ' A' ' 470' ' ' GLU . 54.2 t-20 -93.94 157.65 16.01 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 113.56 -1.655 . . . . 0.0 107.679 -178.005 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -62.84 -34.04 76.51 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 122.032 0.92 . . . . 0.0 108.821 174.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -60.18 -51.02 71.35 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.683 -1.144 . . . . 0.0 108.76 174.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -60.7 -37.64 82.35 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.859 178.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -63.65 -51.69 64.07 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . . . . . . . . 0.256 25.8 m-85 -62.84 -42.3 99.68 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 177.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . 0.466 ' O ' HD13 ' A' ' 511' ' ' LEU . 92.5 t -63.51 -56.7 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.945 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . 0.454 ' HA ' ' CE1' ' A' ' 487' ' ' PHE . 13.6 t80 -49.27 -48.65 45.81 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 177.289 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -61.73 -55.9 25.35 Favored 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 123.185 0.594 . . . . 0.0 111.821 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 42.9 t -61.62 -45.71 98.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.688 0.756 . . . . 0.0 110.717 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.475 HD22 ' HE3' ' A' ' 484' ' ' LYS . 10.3 mp -67.67 -31.57 71.63 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.406 -175.612 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 13.9 t60 -72.31 -32.86 66.92 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.013 176.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.0 -40.81 98.89 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.371 0.605 . . . . 0.0 110.231 -179.28 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -76.3 -36.64 58.26 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.949 176.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . 0.538 ' HA ' ' HB2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -53.25 -34.04 55.56 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.269 1.027 . . . . 0.0 110.223 177.595 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.59 -18.85 62.2 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.281 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -134.13 -57.76 0.85 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 117.686 -1.606 . . . . 0.0 113.772 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -152.03 107.02 3.25 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 106.028 -1.841 . . . . 0.0 106.028 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . 0.538 ' HB2' ' HA ' ' A' ' 515' ' ' TYR . 28.8 t0 -107.56 96.16 6.2 Favored 'General case' 0 C--N 1.284 -2.267 0 N-CA-C 117.718 2.488 . . . . 0.0 117.718 -163.161 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -141.96 126.3 17.63 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 113.984 -1.462 . . . . 0.0 107.722 162.058 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -100.63 132.9 45.78 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -120.19 172.3 7.88 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . 0.439 HG13 HD11 ' A' ' 540' ' ' ILE . 0.9 OUTLIER -52.05 -46.29 42.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 C-N-CA 126.803 2.041 . . . . 0.0 109.877 171.299 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.413 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 2.9 m -51.75 -37.22 50.23 Favored 'General case' 0 N--CA 1.428 -1.533 0 C-N-CA 125.508 1.523 . . . . 0.0 111.627 -176.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -65.23 -50.8 64.46 Favored 'General case' 0 C--O 1.248 0.992 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.799 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . 0.416 ' HB2' HD12 ' A' ' 540' ' ' ILE . . . -65.98 -28.95 69.28 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.384 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.456 ' HA ' HG12 ' A' ' 530' ' ' VAL . 42.7 t -67.97 -35.36 71.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 C-N-CA 125.321 1.448 . . . . 0.0 110.997 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . 0.413 ' HG3' ' O ' ' A' ' 524' ' ' SER . 98.8 mt-30 -65.9 -30.5 71.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 174.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.477 ' HB3' ' HG2' ' A' ' 536' ' ' ARG . 31.5 m-85 -76.5 9.42 2.71 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 175.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.655 ' HA ' ' CZ ' ' A' ' 536' ' ' ARG . 34.4 m -72.7 12.49 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.637 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 -176.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -108.46 -43.66 4.27 Favored 'General case' 0 C--N 1.276 -2.597 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 170.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 6.5 m -75.51 -144.07 0.02 OUTLIER 'General case' 0 C--N 1.289 -2.05 0 C-N-CA 127.73 2.412 . . . . 0.0 112.512 -178.606 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . 0.467 ' C ' ' H ' ' A' ' 535' ' ' LEU . 16.8 m120 -26.64 30.94 0.0 OUTLIER 'General case' 0 CA--C 1.469 -2.14 1 C-N-CA 138.99 6.916 . . . . 0.0 118.402 179.017 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . 0.54 ' HA ' ' NE ' ' A' ' 536' ' ' ARG . 9.0 pt-20 -30.07 -5.91 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.752 0 C-N-CA 130.769 3.628 . . . . 0.0 116.904 -175.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.467 ' H ' ' C ' ' A' ' 533' ' ' ASN . 0.0 OUTLIER -68.55 -12.18 60.94 Favored 'General case' 0 CA--C 1.57 1.745 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 163.86 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . 0.655 ' CZ ' ' HA ' ' A' ' 530' ' ' VAL . 3.8 ppt_? -66.8 -28.76 68.64 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 126.65 1.98 . . . . 0.0 109.9 169.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . 0.623 ' N ' ' HD2' ' A' ' 536' ' ' ARG . 43.3 tt0 -77.05 -41.0 44.2 Favored 'General case' 0 CA--C 1.479 -1.77 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.421 ' O ' ' HB3' ' A' ' 541' ' ' SER . 18.5 m -56.3 -47.73 78.09 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.254 173.194 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 55.7 tp -57.59 -45.65 85.02 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 122.825 0.45 . . . . 0.0 111.526 176.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . 0.439 HD11 HG13 ' A' ' 523' ' ' ILE . 24.8 mm -61.25 -40.45 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 176.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' SER . . . . . 0.421 ' HB3' ' O ' ' A' ' 538' ' ' THR . 35.9 t -57.24 -41.59 79.85 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 123.543 0.737 . . . . 0.0 110.033 174.461 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -63.09 -37.72 88.32 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.164 174.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -68.7 -32.49 72.34 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-O 121.542 0.687 . . . . 0.0 110.441 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.5 tp60 -67.54 -34.95 78.13 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.122 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -70.61 136.41 49.15 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.68 172.117 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -102.75 141.72 35.08 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -169.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 87.1 mt -82.55 4.4 24.7 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.068 -1.424 . . . . 0.0 109.193 171.666 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -73.08 -58.07 3.58 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.955 -1.02 . . . . 0.0 108.71 174.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -74.65 -6.06 46.58 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.226 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -109.22 139.5 21.09 Favored Pre-proline 0 C--N 1.306 -1.287 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.611 177.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . 0.44 ' HD2' ' ND2' ' A' ' 554' ' ' ASN . 16.3 Cg_exo -71.3 152.36 61.14 Favored 'Trans proline' 0 C--O 1.242 0.718 0 N-CA-C 107.166 -1.898 . . . . 0.0 107.166 168.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -76.32 -2.49 31.9 Favored 'General case' 0 CA--C 1.503 -0.833 0 C-N-CA 118.669 -1.212 . . . . 0.0 112.794 -176.215 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . 0.68 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 44.2 mp0 -74.96 -13.48 60.52 Favored 'General case' 0 C--N 1.278 -2.505 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.032 173.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . 0.44 ' ND2' ' HD2' ' A' ' 551' ' ' PRO . 92.7 m-20 -69.31 -21.56 63.85 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.458 172.668 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -78.98 -92.74 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.552 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 28.5 pt -58.89 -45.5 91.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -174.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . 0.68 ' HB3' ' O ' ' A' ' 553' ' ' GLU . 3.4 t70 -60.27 -60.75 3.32 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 117.783 0.265 . . . . 0.0 110.509 -178.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.02 -41.77 98.45 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.976 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -54.69 -52.77 61.36 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 124.251 1.02 . . . . 0.0 111.026 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.07 -46.67 90.62 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.518 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -55.33 -46.42 76.36 Favored 'General case' 0 C--O 1.204 -1.296 0 C-N-CA 123.494 0.717 . . . . 0.0 112.503 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . 0.518 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 53.1 t -66.62 -40.42 86.2 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.123 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.414 HG21 HE21 ' A' ' 469' ' ' GLN . 54.1 mt -83.37 -32.78 9.44 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.298 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.75 -174.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -89.88 -8.24 52.35 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.941 -176.563 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.518 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 12.4 pt-20 -76.72 -20.06 56.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 177.442 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -77.98 53.52 1.19 Allowed 'General case' 0 CA--C 1.562 1.416 0 CA-C-N 113.988 -1.46 . . . . 0.0 109.062 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -134.88 -127.55 2.72 Favored Glycine 0 N--CA 1.404 -3.434 0 N-CA-C 108.18 -1.968 . . . . 0.0 108.18 175.403 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -111.16 13.72 21.82 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -71.63 116.24 11.75 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 113.887 -1.506 . . . . 0.0 111.581 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 570' ' ' THR . . . . . 0.636 ' HB ' ' OE2' ' A' ' 572' ' ' GLU . 1.3 m -97.41 -179.21 4.41 Favored 'General case' 0 N--CA 1.422 -1.83 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 178.392 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 9.5 pt -43.57 -44.35 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -178.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . 0.679 ' OE1' ' HD2' ' A' ' 604' ' ' ARG . 0.0 OUTLIER -83.6 -28.35 28.56 Favored 'General case' 0 C--O 1.172 -2.979 0 C-N-CA 119.755 -0.778 . . . . 0.0 112.926 -179.142 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 573' ' ' SER . . . . . 0.441 ' HA ' ' ND2' ' A' ' 601' ' ' ASN . 17.4 m -65.99 -22.33 66.46 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-O 122.482 1.134 . . . . 0.0 109.558 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . 0.449 ' HG ' ' O ' ' A' ' 570' ' ' THR . 56.4 mt -60.38 -30.93 69.89 Favored 'General case' 0 N--CA 1.421 -1.881 0 CA-C-N 113.846 -1.524 . . . . 0.0 108.422 173.272 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . 0.42 ' HB3' HG22 ' A' ' 598' ' ' VAL . 9.4 m120 -60.13 -47.01 87.7 Favored 'General case' 0 CA--C 1.5 -0.944 0 C-N-CA 123.743 0.817 . . . . 0.0 109.319 177.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . 0.446 ' HB2' ' OD1' ' A' ' 601' ' ' ASN . 16.8 t60 -56.14 -53.77 53.13 Favored 'General case' 0 CA--C 1.495 -1.14 0 O-C-N 124.118 0.886 . . . . 0.0 110.071 -178.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -69.48 -35.16 75.32 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 119.572 -0.851 . . . . 0.0 113.015 -175.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 2.5 tt -61.17 -52.15 66.05 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . . . . . . . . . 26.2 tpt85 -61.36 -38.19 86.07 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.404 178.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -68.65 -46.21 69.78 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.024 -178.227 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -59.97 -45.15 93.6 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 121.291 0.567 . . . . 0.0 111.932 177.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.428 ' C ' ' H ' ' A' ' 584' ' ' ILE . 21.0 p -68.67 -25.91 65.04 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.536 0.734 . . . . 0.0 112.715 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . . . . . . . . . 73.6 ttt180 -53.67 1.86 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 126.713 2.005 . . . . 0.0 114.326 -178.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . 0.428 ' H ' ' C ' ' A' ' 582' ' ' THR . 7.0 tp -80.05 -10.8 12.67 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 CA-C-O 122.053 0.93 . . . . 0.0 110.864 -179.468 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 128.39 50.29 0.14 Allowed Glycine 0 C--N 1.298 -1.554 0 CA-C-O 122.14 0.856 . . . . 0.0 111.597 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . 0.554 ' C ' ' H ' ' A' ' 588' ' ' GLU . 38.9 t70 -95.27 169.24 10.22 Favored 'General case' 0 C--N 1.293 -1.86 0 C-N-CA 126.321 1.849 . . . . 0.0 109.658 179.196 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 29.4 m -46.62 23.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.586 2.338 0 C-N-CA 128.46 2.704 . . . . 0.0 114.914 170.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.554 ' H ' ' C ' ' A' ' 586' ' ' ASP . 37.3 mt-10 -43.11 -2.63 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 130.863 3.665 . . . . 0.0 116.207 -174.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 62.1 tp -72.65 -54.02 10.19 Favored 'General case' 0 C--O 1.266 1.938 0 N-CA-C 105.569 -2.011 . . . . 0.0 105.569 166.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -53.37 -52.66 58.56 Favored 'General case' 0 CA--C 1.5 -0.957 0 CA-C-N 113.875 -1.511 . . . . 0.0 107.619 170.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.442 ' HB2' ' HA ' ' A' ' 588' ' ' GLU 0.39 62.1 mttp -73.78 -9.72 58.95 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 -177.749 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -67.49 -41.16 84.98 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 169.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . 0.4 ' O ' ' HB2' ' A' ' 596' ' ' GLN . 79.7 t80 -61.2 -43.03 99.53 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.154 173.218 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . 0.423 ' O ' ' HB ' ' A' ' 597' ' ' ILE . 38.6 tp -59.24 -36.96 76.41 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 175.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . 0.528 ' HA ' ' CG2' ' A' ' 598' ' ' VAL . 45.6 tt0 -67.64 -19.19 65.18 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.922 178.528 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . 0.404 ' O ' ' HB3' ' A' ' 599' ' ' ALA . 86.5 mm-40 -68.8 -42.73 76.91 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 168.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . 0.423 ' HB ' ' O ' ' A' ' 594' ' ' LEU . 2.1 mp -59.51 -40.8 82.83 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.016 0 CA-C-O 121.887 0.851 . . . . 0.0 109.32 171.439 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . 0.528 ' CG2' ' HA ' ' A' ' 595' ' ' GLN . 58.7 t -63.13 -29.39 47.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.954 174.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . 0.481 ' HA ' ' HE3' ' A' ' 602' ' ' LYS . . . -62.63 -39.57 94.24 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.986 178.008 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . 0.509 ' HB3' ' HZ2' ' A' ' 600' ' ' LYS . 5.1 ttpm? -60.35 -41.41 93.59 Favored 'General case' 0 C--O 1.256 1.437 0 CA-C-O 121.721 0.772 . . . . 0.0 109.351 174.9 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . 0.513 ' HB3' ' O ' ' A' ' 598' ' ' VAL . 1.8 t-20 -56.83 -54.23 48.8 Favored 'General case' 0 C--O 1.201 -1.472 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.099 177.848 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.481 ' HE3' ' HA ' ' A' ' 599' ' ' ALA . 0.0 OUTLIER -73.24 -16.76 61.39 Favored 'General case' 0 C--N 1.273 -2.761 0 C-N-CA 120.064 -0.654 . . . . 0.0 112.247 -179.247 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -79.19 -8.62 59.15 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 171.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . 0.679 ' HD2' ' OE1' ' A' ' 572' ' ' GLU . 15.3 ptm180 -58.13 -22.74 52.26 Favored 'General case' 0 N--CA 1.503 2.221 0 CA-C-O 121.248 0.547 . . . . 0.0 111.391 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 20.5 ptm . . . . . 0 N--CA 1.425 -1.693 0 CA-C-O 118.799 -0.619 . . . . 0.0 110.072 -179.57 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 N--CA 1.449 -0.524 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -96.93 138.73 34.02 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 120.999 0.428 . . . . 0.0 110.907 177.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -136.72 111.05 8.45 Favored 'General case' 0 N--CA 1.402 -2.853 0 N-CA-C 101.44 -3.541 . . . . 0.0 101.44 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.5 pp -49.23 161.3 0.18 Allowed 'General case' 0 C--N 1.267 -3.009 0 N-CA-C 116.137 1.903 . . . . 0.0 116.137 -173.408 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' SER . . . . . 0.433 ' O ' ' HG2' ' A' ' 470' ' ' GLU . 28.8 m -89.14 137.13 32.6 Favored 'General case' 0 N--CA 1.42 -1.959 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.711 -178.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . 0.456 HH21 ' CD ' ' A' ' 565' ' ' GLU . 20.1 ptt180 -60.09 -23.06 63.5 Favored 'General case' 0 C--O 1.26 1.643 0 CA-C-O 122.103 0.954 . . . . 0.0 111.001 176.51 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.461 ' OE1' ' HD2' ' A' ' 566' ' ' LYS . 0.0 OUTLIER -57.03 -38.17 72.78 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.837 177.361 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.637 ' O ' ' HG2' ' A' ' 474' ' ' ARG . 9.1 pt-20 -71.22 -21.9 62.07 Favored 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 119.281 -0.968 . . . . 0.0 111.699 -174.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -73.1 -39.99 65.35 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -60.75 -40.45 92.5 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.091 175.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . 0.401 ' HG2' ' HA ' ' A' ' 470' ' ' GLU . 49.0 mm-40 -61.16 -35.71 77.86 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.79 176.529 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.637 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 21.0 mmt85 -58.63 -42.26 87.87 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -71.46 -47.42 55.82 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.581 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -58.43 -34.15 70.48 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 122.231 1.015 . . . . 0.0 110.794 -178.017 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . 0.407 HD21 HG12 ' A' ' 507' ' ' VAL . 23.7 tp -61.49 -10.62 8.17 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 125.987 1.715 . . . . 0.0 111.776 178.245 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.567 ' HD2' ' O ' ' A' ' 542' ' ' LEU . 9.0 mmpt? -82.57 -12.17 57.91 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.334 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 44.6 m170 -70.96 138.71 50.24 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.861 177.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 95.1 mt -65.62 137.99 57.71 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 121.478 0.656 . . . . 0.0 111.377 -175.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' MET . . . . . 0.478 ' C ' ' HG3' ' A' ' 520' ' ' GLN . 0.9 OUTLIER -67.13 3.28 1.2 Allowed 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.449 -1.251 . . . . 0.0 114.305 -174.235 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . 0.451 ' N ' ' HG3' ' A' ' 520' ' ' GLN . 18.8 tpt180 -66.8 -35.17 79.45 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 172.184 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -77.5 59.71 1.96 Allowed 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.363 172.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -44.13 -30.3 0.74 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.138 1.375 . . . . 0.0 111.999 177.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -56.73 -58.57 7.51 Favored 'General case' 0 C--O 1.197 -1.663 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.699 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 98.8 m -53.19 -39.35 63.58 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.323 0.649 . . . . 0.0 112.002 -178.341 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . 0.441 ' CE1' ' HB3' ' A' ' 511' ' ' LEU . 41.6 t80 -54.87 -59.48 4.68 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 121.106 0.479 . . . . 0.0 109.985 177.646 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 99.6 mt -81.64 -19.22 42.22 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 120.131 -0.628 . . . . 0.0 112.477 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -70.97 -39.09 72.73 Favored 'General case' 0 CA--C 1.5 -0.97 0 C-N-CA 122.702 0.401 . . . . 0.0 110.23 177.672 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -34.15 53.41 Favored 'General case' 0 N--CA 1.425 -1.679 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -178.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -66.36 -24.02 66.43 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 120.188 -0.605 . . . . 0.0 112.457 172.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -88.75 -27.26 21.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 121.029 0.443 . . . . 0.0 111.728 176.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 50.1 m -75.94 -31.02 58.89 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 121.823 -0.548 . . . . 0.0 110.911 -178.014 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 34.3 t -106.89 155.54 7.55 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 177.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -93.24 134.75 35.12 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 119.038 -1.065 . . . . 0.0 108.457 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . 0.26 0.1 OUTLIER -89.59 -42.69 11.26 Favored 'General case' 0 C--N 1.285 -2.231 0 N-CA-C 117.55 2.426 . . . . 0.0 117.55 -164.919 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -60.21 -42.64 95.58 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 -165.751 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -93.81 -22.89 18.39 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 119.135 -1.026 . . . . 0.0 112.099 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -81.79 -26.85 34.05 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.136 0.493 . . . . 0.0 111.37 -174.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 89.5 m -71.81 101.39 2.6 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.553 0.692 . . . . 0.0 111.476 -179.348 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -78.4 167.86 20.68 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 171.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -58.59 -25.94 63.12 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.357 0.526 . . . . 0.0 110.212 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . 0.647 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 14.8 m80 -57.69 -60.16 4.11 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.76 174.283 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -61.0 -32.22 71.81 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.055 -0.975 . . . . 0.0 112.004 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -64.37 -46.73 82.11 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 123.332 0.653 . . . . 0.0 110.676 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.647 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.266 13.7 p90 -66.06 -36.83 84.26 Favored 'General case' 0 N--CA 1.437 -1.083 0 C-N-CA 118.255 -1.378 . . . . 0.0 111.862 179.856 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . 0.484 HG23 ' O ' ' A' ' 503' ' ' HIS . 12.9 t -66.5 -53.38 36.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.554 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -48.24 -45.94 34.93 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 124.283 0.989 . . . . 0.0 110.51 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -57.42 -53.56 56.78 Favored 'General case' 0 C--O 1.209 -1.069 0 O-C-N 123.848 0.717 . . . . 0.0 111.649 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.482 HG21 ' O ' ' A' ' 506' ' ' TYR . 21.8 t -55.85 -54.7 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 CA-C-O 121.543 0.687 . . . . 0.0 109.729 -178.431 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.441 ' HB3' ' CE1' ' A' ' 487' ' ' PHE . 7.4 mp -60.88 -53.96 50.9 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.759 -175.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -65.86 -38.03 87.76 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 123.829 0.852 . . . . 0.0 112.304 -177.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -67.52 -40.63 85.08 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 117.469 0.122 . . . . 0.0 111.18 -176.564 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -71.58 -49.05 44.14 Favored 'General case' 0 C--O 1.204 -1.342 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -50.88 -39.75 54.77 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.291 1.036 . . . . 0.0 110.451 178.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -62.11 -29.71 70.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.982 -0.553 . . . . 0.0 112.186 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -107.31 -40.43 5.39 Favored 'General case' 0 C--N 1.307 -1.257 0 C-N-CA 119.884 -0.726 . . . . 0.0 111.388 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . 0.409 ' CG ' ' H ' ' A' ' 519' ' ' ASP . 65.6 t30 -128.21 -176.92 3.95 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.809 -167.828 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . 0.409 ' H ' ' CG ' ' A' ' 518' ' ' ASN . 2.5 p30 -76.41 -154.84 0.05 Allowed 'General case' 0 C--N 1.293 -1.885 0 C-N-CA 128.002 2.521 . . . . 0.0 112.001 177.962 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . 0.478 ' HG3' ' C ' ' A' ' 481' ' ' MET . 6.1 tt0 -58.51 146.97 33.6 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 125.068 1.347 . . . . 0.0 112.111 -166.392 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -90.87 146.33 24.01 Favored 'General case' 0 N--CA 1.383 -3.785 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -112.98 157.62 21.27 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.062 -176.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.6 pp -72.11 -10.81 14.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.676 0.751 . . . . 0.0 110.601 178.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 19.4 m -58.38 -38.35 77.12 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.203 170.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -65.12 -36.11 83.25 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.032 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -61.57 -48.84 79.13 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.2 177.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.424 ' O ' HG21 ' A' ' 530' ' ' VAL . 10.6 p -68.36 -28.47 40.7 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-O 121.324 0.583 . . . . 0.0 110.961 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -74.51 -12.14 60.4 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.559 -0.713 . . . . 0.0 110.633 173.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -29.28 47.17 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.502 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.424 HG21 ' O ' ' A' ' 527' ' ' VAL 0.337 30.1 m -73.93 54.02 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -173.592 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -107.07 -29.06 9.62 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 173.385 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 13.0 m -90.33 155.48 18.94 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 172.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -69.12 -73.76 0.14 Allowed 'General case' 0 C--O 1.203 -1.359 0 N-CA-C 116.483 2.031 . . . . 0.0 116.483 -172.825 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -80.19 -64.34 1.21 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -164.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 84.5 mt -57.15 -42.49 81.11 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-O 121.702 0.763 . . . . 0.0 112.46 -168.208 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -79.55 -29.31 41.32 Favored 'General case' 0 N--CA 1.398 -3.044 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.962 -175.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -70.03 -39.97 75.46 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 174.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 40.3 m -54.28 -46.12 72.64 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.892 177.861 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -60.88 -43.67 98.15 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.631 178.836 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 13.8 mm -62.86 -40.71 89.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 CA-C-O 120.836 0.35 . . . . 0.0 110.923 176.228 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' SER . . . . . 0.48 ' HA ' HE21 ' A' ' 544' ' ' GLN . 49.1 m -54.1 -41.42 68.28 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.381 174.514 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.567 ' O ' ' HD2' ' A' ' 478' ' ' LYS . 10.3 mp -66.79 -49.79 64.72 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.611 172.129 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -54.39 -46.72 73.16 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 125.423 1.489 . . . . 0.0 111.608 -173.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . 0.48 HE21 ' HA ' ' A' ' 541' ' ' SER . 29.0 pt20 -72.78 12.74 0.46 Allowed 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -176.808 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -67.03 133.39 49.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 172.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -93.31 92.2 7.58 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.883 -0.727 . . . . 0.0 109.48 -177.627 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 3.5 pp -81.86 -22.78 36.75 Favored 'General case' 0 C--O 1.205 -1.24 0 CA-C-N 115.428 -0.806 . . . . 0.0 112.077 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -75.61 -12.4 60.2 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.932 0.872 . . . . 0.0 110.292 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -71.7 -36.0 70.42 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.454 -1.248 . . . . 0.0 112.26 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -125.16 143.59 44.74 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-O 119.308 -0.377 . . . . 0.0 110.132 -174.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -36.79 129.17 0.49 Allowed 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 124.084 3.189 . . . . 0.0 113.246 174.132 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -79.93 -15.35 57.49 Favored 'General case' 0 CA--C 1.491 -1.299 0 CA-C-O 122.331 1.062 . . . . 0.0 110.502 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -78.8 -12.79 60.04 Favored 'General case' 0 N--CA 1.401 -2.924 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.137 175.765 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -74.09 -36.45 64.28 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 175.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -59.04 -60.13 4.36 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.628 -177.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 31.2 pt -57.74 -34.4 47.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 O-C-N 123.34 0.4 . . . . 0.0 111.935 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . 0.5 ' HB2' ' HZ2' ' A' ' 591' ' ' LYS . 11.0 t70 -62.77 -56.28 18.98 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.868 0.842 . . . . 0.0 109.234 178.626 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . 0.625 ' O ' HG21 ' A' ' 562' ' ' VAL . 27.0 t70 -59.45 -50.37 74.19 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.504 -1.225 . . . . 0.0 109.754 178.178 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.494 ' O ' HD11 ' A' ' 563' ' ' ILE . 78.0 t80 -50.82 -53.51 31.49 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 125.564 1.546 . . . . 0.0 111.973 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . 0.456 ' O ' ' HB3' ' A' ' 564' ' ' ASN . 14.4 p -59.84 -40.14 81.9 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.51 -178.479 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -62.62 -47.65 82.84 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 123.128 0.571 . . . . 0.0 111.287 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . 0.625 HG21 ' O ' ' A' ' 558' ' ' ASP . 38.2 t -69.81 -30.03 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 C-N-CA 123.87 0.868 . . . . 0.0 112.236 -178.497 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.494 HD11 ' O ' ' A' ' 559' ' ' TYR . 1.3 mp -86.84 -48.98 15.27 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.489 0 CA-C-O 122.222 1.01 . . . . 0.0 109.346 -172.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . 0.456 ' HB3' ' O ' ' A' ' 560' ' ' VAL . 26.9 t-20 -78.26 4.35 13.0 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.18 -1.373 . . . . 0.0 109.582 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.456 ' CD ' HH21 ' A' ' 468' ' ' ARG . 2.5 tm-20 -65.3 -28.07 69.06 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 172.361 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . 0.461 ' HD2' ' OE1' ' A' ' 469' ' ' GLN . 68.4 mttm -79.48 16.03 1.14 Allowed 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.068 175.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -130.72 -64.26 0.1 OUTLIER Glycine 0 N--CA 1.42 -2.422 0 N-CA-C 106.417 -2.673 . . . . 0.0 106.417 171.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 50.99 105.67 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 127.412 2.285 . . . . 0.0 115.212 173.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -94.96 -178.92 4.65 Favored 'General case' 0 C--N 1.286 -2.152 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 172.714 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.03 162.04 23.04 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . 0.418 HD13 ' N ' ' A' ' 571' ' ' ILE . 0.1 OUTLIER -46.4 -42.62 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.616 0 C-N-CA 125.595 1.558 . . . . 0.0 113.774 -179.456 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.97 -36.43 56.47 Favored 'General case' 0 N--CA 1.417 -2.085 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.551 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 573' ' ' SER . . . . . 0.534 ' O ' ' HB3' ' A' ' 576' ' ' HIS . 24.7 t -69.83 -41.94 74.28 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.786 177.519 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . 0.401 ' O ' ' HG ' ' A' ' 578' ' ' LEU 0.251 3.9 pp -67.39 -32.68 73.75 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 119.675 -0.81 . . . . 0.0 111.146 175.849 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . 0.583 ' O ' ' HG3' ' A' ' 579' ' ' ARG . 5.3 t30 -58.81 -49.18 78.66 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 172.223 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . 0.534 ' HB3' ' O ' ' A' ' 573' ' ' SER . 3.6 t60 -54.21 -47.85 71.69 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.876 1.27 . . . . 0.0 109.241 176.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -60.13 -52.9 63.36 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 123.855 0.862 . . . . 0.0 111.217 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' A' ' 574' ' ' LEU . 96.8 mt -57.06 -57.41 12.68 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.936 -179.381 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.583 ' HG3' ' O ' ' A' ' 575' ' ' ASN 0.28 0.0 OUTLIER -62.61 -25.9 68.34 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -178.876 . . . . . . . . 4 4 . 1 . 002 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . 0.586 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 41.1 tt0 -71.21 -34.94 71.32 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.31 177.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.53 81.38 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.097 0.475 . . . . 0.0 111.258 177.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.601 ' HB ' ' O ' ' A' ' 588' ' ' GLU . 19.8 p -70.28 -28.09 64.93 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-O 122.046 0.926 . . . . 0.0 112.527 -177.196 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.586 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 32.0 ttt-85 -51.42 -2.9 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.266 0 C-N-CA 128.39 2.676 . . . . 0.0 114.582 175.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 17.9 tt -76.17 -11.32 13.91 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.804 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 -171.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 100.89 1.1 55.07 Favored Glycine 0 N--CA 1.487 2.094 0 C-N-CA 119.683 -1.246 . . . . 0.0 113.223 176.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -81.91 167.8 18.57 Favored 'General case' 0 C--N 1.283 -2.322 0 C-N-CA 125.349 1.459 . . . . 0.0 108.43 176.062 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.555 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 55.5 t -48.5 -19.39 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-N 119.68 1.127 . . . . 0.0 110.086 171.0 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.601 ' O ' ' HB ' ' A' ' 582' ' ' THR . 5.9 mm-40 -55.6 -25.32 37.96 Favored 'General case' 0 C--O 1.182 -2.462 0 O-C-N 121.87 -0.519 . . . . 0.0 111.209 167.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . 0.601 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 50.8 tp -72.2 -33.35 67.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.707 0.765 . . . . 0.0 109.156 176.624 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . 0.555 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 42.5 tt0 -60.34 -41.7 94.15 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 171.157 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.5 ' HZ2' ' HB2' ' A' ' 557' ' ' ASP . 25.8 tttm -76.19 -21.44 56.47 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.295 -1.321 . . . . 0.0 111.144 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.626 ' HA ' ' OE1' ' A' ' 595' ' ' GLN . 46.7 t80 -59.13 -42.13 89.88 Favored 'General case' 0 CA--C 1.502 -0.868 0 C-N-CA 124.143 0.977 . . . . 0.0 108.681 171.461 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . 0.604 ' O ' HG12 ' A' ' 597' ' ' ILE . 42.3 t80 -59.67 -35.14 73.85 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.181 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . 0.463 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 6.9 tt -62.42 -42.77 99.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.052 0.541 . . . . 0.0 110.59 176.601 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . 0.626 ' OE1' ' HA ' ' A' ' 592' ' ' TYR . 9.2 mp0 -67.16 -32.41 73.5 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 120.631 -0.427 . . . . 0.0 110.7 175.89 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . 0.412 ' HB3' ' O ' ' A' ' 593' ' ' TYR . 53.0 tt0 -62.85 -41.46 99.36 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.013 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . 0.604 HG12 ' O ' ' A' ' 593' ' ' TYR . 43.8 mm -56.04 -53.22 41.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 173.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 97.9 t -60.94 -36.31 71.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.228 -178.382 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -58.93 -47.95 83.22 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 122.491 0.316 . . . . 0.0 110.184 177.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -64.95 -44.61 88.85 Favored 'General case' 0 C--O 1.206 -1.232 0 O-C-N 123.517 0.511 . . . . 0.0 110.423 176.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -60.95 -44.36 97.38 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -177.226 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.467 ' HG3' ' HG3' ' A' ' 603' ' ' GLU . 25.1 pttm -69.74 -43.3 72.58 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.573 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . 0.467 ' HG3' ' HG3' ' A' ' 602' ' ' LYS . 31.1 mt-10 -81.97 2.75 29.36 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 123.772 0.829 . . . . 0.0 112.769 -178.143 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -73.06 -29.65 63.13 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 123.514 0.726 . . . . 0.0 109.742 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 64.7 mtt . . . . . 0 C--O 1.246 0.918 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.576 -177.132 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 . . . . . 0 N--CA 1.435 -1.188 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -126.95 40.62 3.68 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 30.1 p-10 -136.17 48.15 2.18 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 113.347 -1.751 . . . . 0.0 109.5 178.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.36 80.84 0.15 Allowed 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' SER . . . . . 0.501 ' OG ' ' HB2' ' A' ' 469' ' ' GLN . 21.9 t -111.27 124.16 51.67 Favored 'General case' 0 N--CA 1.405 -2.71 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -169.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -67.3 -28.84 68.33 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 168.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.501 ' HB2' ' OG ' ' A' ' 467' ' ' SER . 1.7 mp0 -68.66 -42.97 77.15 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 124.445 1.098 . . . . 0.0 110.18 -178.41 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.553 ' OE2' ' HB2' ' A' ' 501' ' ' ASN . 0.7 OUTLIER -68.61 -34.8 76.4 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.266 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -63.49 -36.09 82.6 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.178 172.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -62.65 -33.67 75.51 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.299 0.571 . . . . 0.0 109.91 176.834 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -73.72 -28.69 61.84 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.808 175.905 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -69.07 -32.92 72.72 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 173.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -69.4 -40.93 77.06 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.504 174.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -59.37 -27.78 66.27 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.697 176.003 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 19.4 mt -69.97 -8.97 53.34 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 178.22 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.522 ' HZ1' ' CD ' ' A' ' 555' ' ' GLU . 59.3 pttt -43.08 -51.13 5.96 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 124.386 1.054 . . . . 0.0 110.289 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . 0.489 ' N ' ' HG3' ' A' ' 478' ' ' LYS . 3.9 p80 46.29 161.31 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 128.488 2.715 . . . . 0.0 116.218 178.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 65.2 mt -143.21 -154.66 0.54 Allowed 'General case' 0 C--N 1.281 -2.407 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 170.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.34 -28.27 19.94 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . 0.626 ' HG3' ' N ' ' A' ' 483' ' ' ASP . 23.2 ptt180 -64.41 -52.96 55.53 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.991 1.317 . . . . 0.0 113.078 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.626 ' N ' ' HG3' ' A' ' 482' ' ' ARG 0.252 1.1 p30 -76.6 31.29 0.13 Allowed 'General case' 0 N--CA 1.419 -1.993 0 N-CA-C 117.172 2.286 . . . . 0.0 117.172 -164.979 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . 0.489 ' HD2' ' N ' ' A' ' 485' ' ' ASP . 0.1 OUTLIER -67.41 -28.43 67.91 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 170.695 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . 0.489 ' N ' ' HD2' ' A' ' 484' ' ' LYS . 4.7 p-10 -63.05 -44.77 94.92 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.304 174.985 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.453 ' HB ' ' HB2' ' A' ' 483' ' ' ASP . 43.5 m -65.17 -39.98 93.68 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 124.015 0.926 . . . . 0.0 110.17 -179.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -54.34 -54.46 40.07 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.208 174.423 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 36.2 tp -66.14 -34.22 77.55 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.671 -177.062 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -67.68 -31.13 70.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.714 -178.219 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.61 -41.55 19.35 Favored 'General case' 0 N--CA 1.401 -2.907 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.99 -52.11 66.87 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.264 1.826 . . . . 0.0 110.831 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.39 -20.08 59.15 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.313 -173.216 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 59.4 m -81.13 -47.23 13.77 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 119.917 -0.713 . . . . 0.0 111.982 -174.709 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 40.1 t -137.31 123.43 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 C-N-CA 120.464 -0.494 . . . . 0.0 109.813 -175.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -86.63 45.64 1.27 Allowed 'General case' 0 CA--C 1.55 0.965 0 CA-C-O 122.606 1.193 . . . . 0.0 110.146 -177.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 50.9 pttt -89.16 14.83 9.92 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.659 -177.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.27 -11.05 48.1 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 -170.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -84.66 -22.66 29.78 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.875 0.845 . . . . 0.0 109.14 175.371 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -79.99 -43.58 21.75 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.4 m -54.94 154.05 5.69 Favored 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.876 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.553 ' HB2' ' OE2' ' A' ' 470' ' ' GLU . 12.7 t-20 -66.42 150.02 49.54 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 124.806 1.242 . . . . 0.0 111.496 -174.533 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -65.41 -21.73 66.7 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.048 0.539 . . . . 0.0 110.313 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . 0.637 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 49.3 m80 -61.43 -44.25 97.45 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -65.78 -31.73 72.87 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.331 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 46.8 tttm -61.81 -52.93 62.15 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 122.635 0.374 . . . . 0.0 110.594 -178.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.637 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.282 47.0 p90 -66.2 -25.19 66.81 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 117.516 -1.674 . . . . 0.0 111.863 -179.796 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 97.4 t -72.53 -40.38 63.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.367 174.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 8.2 m-85 -48.67 -50.47 32.97 Favored 'General case' 0 C--O 1.199 -1.6 0 C-N-CA 123.399 0.679 . . . . 0.0 109.526 171.139 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . 0.443 ' O ' ' HB2' ' A' ' 513' ' ' ASP . 38.6 mt-10 -57.28 -49.7 75.26 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.371 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.5 HG22 ' O ' ' A' ' 506' ' ' TYR . 9.9 t -60.43 -53.82 43.51 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.832 0 O-C-N 123.75 0.656 . . . . 0.0 109.262 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 95.8 mt -69.24 -32.29 71.41 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 113.431 0.9 . . . . 0.0 113.431 -174.515 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -67.07 -49.47 64.99 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.237 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . 0.443 ' HB2' ' O ' ' A' ' 509' ' ' GLU . 0.4 OUTLIER -58.55 -38.39 77.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.368 173.843 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . 0.661 ' O ' ' HA ' ' A' ' 518' ' ' ASN . 13.8 m-85 -75.75 -3.87 37.29 Favored 'General case' 0 C--O 1.186 -2.279 0 C-N-CA 124.886 1.275 . . . . 0.0 114.31 174.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . 0.499 ' O ' ' HB3' ' A' ' 518' ' ' ASN . 2.6 m-85 -82.83 -35.62 26.22 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 121.154 -0.966 . . . . 0.0 110.356 165.778 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -68.61 -47.17 67.35 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 170.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -99.02 61.45 1.25 Allowed 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 104.752 -2.314 . . . . 0.0 104.752 174.142 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . 0.661 ' HA ' ' O ' ' A' ' 514' ' ' PHE . 3.1 p-10 -59.61 -151.27 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 128.844 2.858 . . . . 0.0 116.125 -163.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . 0.358 3.3 p30 -31.54 -152.75 0.0 OUTLIER 'General case' 0 N--CA 1.528 3.441 0 N-CA-C 119.605 3.187 . . . . 0.0 119.605 -138.334 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -53.18 125.07 16.28 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 124.01 1.862 . . . . 0.0 114.937 -145.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.83 176.58 6.21 Favored 'General case' 0 N--CA 1.416 -2.134 0 CA-C-N 109.648 -3.433 . . . . 0.0 110.483 -168.466 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -108.03 136.51 47.6 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -174.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 36.8 pt -79.19 -14.48 13.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 175.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.455 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 37.0 t -57.13 -30.97 64.87 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.642 172.071 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -63.03 -42.58 99.82 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . 0.413 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -62.17 -45.27 94.17 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.295 177.227 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.465 ' O ' HG13 ' A' ' 530' ' ' VAL . 61.8 t -62.1 -26.07 39.12 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.702 0 CA-C-O 121.493 0.663 . . . . 0.0 111.186 175.463 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . 0.53 HE21 ' HA ' ' A' ' 528' ' ' GLN . 0.0 OUTLIER -71.16 -23.53 62.08 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 120.759 -1.213 . . . . 0.0 109.709 174.811 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.439 ' O ' ' HD3' ' A' ' 536' ' ' ARG . 16.2 m-85 -70.61 -31.71 68.78 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.901 174.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.465 HG13 ' O ' ' A' ' 527' ' ' VAL 0.326 14.6 p -74.97 54.73 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.321 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -172.406 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -107.02 -42.26 4.95 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 173.502 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 11.7 m -79.0 141.44 37.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 106.004 -1.85 . . . . 0.0 106.004 171.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -68.11 -84.0 0.03 OUTLIER 'General case' 0 C--O 1.198 -1.641 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 -173.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -52.63 -64.98 0.64 Allowed 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 116.113 1.894 . . . . 0.0 116.113 -166.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 44.8 tp -57.14 -57.05 14.3 Favored 'General case' 0 C--O 1.267 2.004 0 CA-C-O 122.579 1.18 . . . . 0.0 111.299 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . 0.439 ' HD3' ' O ' ' A' ' 529' ' ' TYR . 62.8 mtt85 -76.19 -38.25 56.79 Favored 'General case' 0 N--CA 1.41 -2.462 0 CA-C-N 114.11 -1.405 . . . . 0.0 113.686 -171.44 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -61.27 -43.88 98.15 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 118.243 0.474 . . . . 0.0 110.042 175.3 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.488 ' O ' HD11 ' A' ' 542' ' ' LEU . 93.4 m -55.44 -43.39 75.37 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 123.779 0.674 . . . . 0.0 111.045 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . 0.453 ' HB2' ' OH ' ' A' ' 506' ' ' TYR . 0.4 OUTLIER -57.9 -45.3 86.67 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.514 177.465 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . 0.581 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 1.7 mp -58.28 -43.96 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 CA-C-O 121.009 0.433 . . . . 0.0 110.368 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 19.8 m -54.5 -41.98 70.23 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.211 174.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.488 HD11 ' O ' ' A' ' 538' ' ' THR . 9.1 mp -62.83 -42.12 99.6 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.909 0.484 . . . . 0.0 110.472 175.573 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . 0.47 ' HA ' ' O ' ' A' ' 478' ' ' LYS . 40.5 tt0 -61.1 -37.23 82.01 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.166 0.986 . . . . 0.0 111.78 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 72.8 mt-30 -68.83 -29.0 67.24 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.138 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -76.96 84.4 3.49 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-O 121.767 0.794 . . . . 0.0 111.576 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -136.87 136.58 38.85 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.568 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 6.8 mp -90.35 23.54 2.9 Favored 'General case' 0 C--N 1.299 -1.596 0 C-N-CA 124.288 1.035 . . . . 0.0 111.209 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.08 -23.34 66.44 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -170.537 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -70.08 -15.49 62.99 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.891 0.377 . . . . 0.0 111.033 176.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -117.61 118.32 35.26 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -84.63 38.74 0.7 Allowed 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.948 2.432 . . . . 0.0 110.968 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -128.5 48.61 2.29 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -70.03 66.82 0.27 Allowed 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -175.586 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.07 -21.86 65.87 Favored 'General case' 0 C--O 1.214 -0.789 0 C-N-CA 125.657 1.583 . . . . 0.0 109.114 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . 0.522 ' CD ' ' HZ1' ' A' ' 478' ' ' LYS . 0.7 OUTLIER -45.37 -38.44 5.87 Favored 'General case' 0 C--O 1.197 -1.659 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.89 174.021 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 43.9 mt -70.93 -42.24 77.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 123.283 0.633 . . . . 0.0 109.545 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -60.49 -47.3 86.75 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 121.957 0.884 . . . . 0.0 109.389 176.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -57.64 -48.54 79.18 Favored 'General case' 0 C--O 1.211 -0.954 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.296 175.673 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.48 ' O ' HG13 ' A' ' 563' ' ' ILE . 27.9 t80 -56.89 -53.86 53.17 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 125.47 1.508 . . . . 0.0 110.42 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 40.4 t -58.4 -54.98 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.225 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.598 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . 0.426 ' ND2' ' HB2' ' A' ' 576' ' ' HIS . 2.4 t30 -63.68 -42.78 97.98 Favored 'General case' 0 C--O 1.181 -2.502 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.994 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 2.6 p -65.75 -33.64 64.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 118.158 0.435 . . . . 0.0 112.108 -173.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.48 HG13 ' O ' ' A' ' 559' ' ' TYR . 27.9 mt -84.82 -29.24 6.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.538 0.685 . . . . 0.0 109.567 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -78.47 -36.19 45.61 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.668 -178.692 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.42 ' HG2' ' O ' ' A' ' 561' ' ' ASN . 12.3 pt-20 -75.09 -7.65 54.34 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 122.186 0.993 . . . . 0.0 110.401 -177.999 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -72.11 -26.13 62.01 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.988 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -93.72 -24.36 20.9 Favored Glycine 0 N--CA 1.436 -1.363 0 C-N-CA 119.77 -1.205 . . . . 0.0 112.571 -176.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . 0.489 ' HG2' ' HG3' ' A' ' 569' ' ' GLU . 4.6 pm0 -174.36 166.26 4.01 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -176.56 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . 0.489 ' HG3' ' HG2' ' A' ' 568' ' ' GLN . 42.0 mt-10 79.39 133.19 0.06 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.967 1.307 . . . . 0.0 113.042 176.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 570' ' ' THR . . . . . 0.502 ' O ' ' HB2' ' A' ' 573' ' ' SER . 23.8 m -127.01 -37.47 2.09 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.901 -176.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 4.0 mt -75.51 -24.02 17.0 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.171 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . 0.516 ' OE1' ' HG2' ' A' ' 602' ' ' LYS . 43.7 mm-40 -74.88 -22.88 58.39 Favored 'General case' 0 N--CA 1.409 -2.516 0 CA-C-N 113.579 -1.646 . . . . 0.0 111.014 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 573' ' ' SER . . . . . 0.502 ' HB2' ' O ' ' A' ' 570' ' ' THR . 66.6 m -63.26 -35.64 81.0 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 173.077 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . 0.538 ' O ' ' HB3' ' A' ' 577' ' ' LYS . 50.1 mt -65.6 -41.34 92.89 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.165 174.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . 0.468 ' O ' ' HG3' ' A' ' 579' ' ' ARG . 28.5 t-20 -60.59 -40.58 92.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.24 176.192 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . 0.426 ' HB2' ' ND2' ' A' ' 561' ' ' ASN . 13.5 t-160 -56.43 -47.26 79.45 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 175.595 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . 0.538 ' HB3' ' O ' ' A' ' 574' ' ' LEU . 80.0 tttt -48.95 -47.23 43.99 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.461 0.705 . . . . 0.0 111.372 176.776 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 71.7 mt -58.1 -51.9 67.76 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.324 0.649 . . . . 0.0 111.322 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.769 ' O ' ' HB ' ' A' ' 582' ' ' THR . 8.5 mtm-85 -66.35 -34.96 79.14 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 122.541 1.162 . . . . 0.0 110.412 -178.822 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . 0.45 ' O ' ' HG2' ' A' ' 583' ' ' ARG . 36.7 tt0 -61.33 -44.62 96.88 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.162 174.365 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -60.09 -33.72 72.47 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.747 0.784 . . . . 0.0 110.05 175.757 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.769 ' HB ' ' O ' ' A' ' 579' ' ' ARG . 16.0 m -61.89 -33.6 74.51 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 125.93 1.692 . . . . 0.0 113.002 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.45 ' HG2' ' O ' ' A' ' 580' ' ' GLU . 34.9 ptt180 -50.11 -13.64 0.12 Allowed 'General case' 0 N--CA 1.515 2.801 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -178.52 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 20.2 tt -77.85 -6.35 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.714 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -171.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 85.78 15.16 66.1 Favored Glycine 0 N--CA 1.472 1.097 0 C-N-CA 119.932 -1.128 . . . . 0.0 113.075 176.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -83.16 166.07 18.96 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 106.97 -1.492 . . . . 0.0 106.97 175.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.522 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 35.6 m -54.63 -4.67 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 CA-C-N 119.649 1.113 . . . . 0.0 112.568 173.16 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.528 ' O ' ' HB3' ' A' ' 591' ' ' LYS . 31.8 mt-10 -59.79 -14.97 17.05 Favored 'General case' 0 C--O 1.191 -1.995 0 O-C-N 121.837 -0.54 . . . . 0.0 110.293 164.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . 0.456 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 6.4 tt -71.81 -41.19 68.55 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 172.725 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . 0.522 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 6.9 tt0 -57.26 -36.51 71.06 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-O 122.182 0.992 . . . . 0.0 108.606 170.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.563 ' O ' ' HG2' ' A' ' 595' ' ' GLN . 84.5 tttt -71.56 -30.66 66.11 Favored 'General case' 0 C--O 1.19 -2.035 0 CA-C-N 114.059 -1.428 . . . . 0.0 110.522 176.409 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.456 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 84.1 t80 -57.32 -42.16 81.31 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 124.148 0.979 . . . . 0.0 109.047 175.753 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . 0.429 ' O ' HG13 ' A' ' 597' ' ' ILE . 61.1 t80 -58.49 -44.94 89.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.8 177.305 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . 0.485 ' O ' HG21 ' A' ' 598' ' ' VAL . 56.3 tp -62.94 -44.59 95.66 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.471 175.369 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . 0.563 ' HG2' ' O ' ' A' ' 591' ' ' LYS . 83.4 mm-40 -60.23 -42.65 95.68 Favored 'General case' 0 CA--C 1.509 -0.617 0 C-N-CA 123.547 0.739 . . . . 0.0 112.274 -177.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 -67.01 -37.01 83.41 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.067 -0.653 . . . . 0.0 109.354 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . 0.429 HG13 ' O ' ' A' ' 593' ' ' TYR . 67.0 mt -58.44 -45.15 89.97 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 172.945 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . 0.485 HG21 ' O ' ' A' ' 594' ' ' LEU . 99.5 t -61.42 -40.05 84.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 C-N-CA 123.114 0.566 . . . . 0.0 110.353 178.038 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -61.18 -46.99 88.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.114 176.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -63.57 -39.88 95.54 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.803 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -60.81 -41.59 95.98 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.967 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.516 ' HG2' ' OE1' ' A' ' 572' ' ' GLU 0.268 0.0 OUTLIER -72.09 -28.41 63.28 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 119.247 -0.981 . . . . 0.0 112.666 178.459 . . . . . . . . 4 4 . 1 . 003 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -74.01 -33.6 63.86 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 174.299 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -68.01 -42.45 80.69 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 123.892 0.877 . . . . 0.0 111.125 177.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 56.5 ttm . . . . . 0 C--N 1.308 -1.228 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.152 -177.294 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 13.8 p90 . . . . . 0 N--CA 1.411 -2.394 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -93.67 135.3 35.09 Favored 'General case' 0 C--N 1.284 -2.24 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 173.856 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -128.32 69.58 1.36 Allowed 'General case' 0 C--N 1.286 -2.181 0 CA-C-O 121.827 0.822 . . . . 0.0 110.059 -178.152 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.93 116.82 8.21 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 113.93 -1.486 . . . . 0.0 108.492 174.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' SER . . . . . 0.531 ' O ' ' HG2' ' A' ' 470' ' ' GLU . 47.3 t -95.05 141.09 29.1 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.681 -174.756 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -65.67 -22.42 66.64 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.252 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -62.26 -36.93 83.57 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.46 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.531 ' HG2' ' O ' ' A' ' 467' ' ' SER . 14.4 pt-20 -74.96 -23.92 58.37 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.723 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -71.35 -36.49 71.52 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -63.04 -48.41 78.83 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.59 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -56.66 -41.7 77.71 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.179 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.484 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 9.9 mmt-85 -57.41 -40.89 79.27 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.163 0.506 . . . . 0.0 109.89 175.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . 0.647 ' O ' ' HG3' ' A' ' 478' ' ' LYS . . . -65.54 -40.22 92.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.939 -178.449 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.57 -48.04 76.48 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.857 0.837 . . . . 0.0 110.81 173.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 31.8 tp -70.26 -3.17 15.84 Favored 'General case' 0 CA--C 1.571 1.761 0 C-N-CA 126.289 1.836 . . . . 0.0 114.456 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.647 ' HG3' ' O ' ' A' ' 475' ' ' ALA . 35.4 mtmm -41.66 -63.47 0.71 Allowed 'General case' 0 N--CA 1.511 2.579 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -172.214 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . 0.523 ' CG ' ' HA ' ' A' ' 543' ' ' GLU . 0.4 OUTLIER -170.15 89.7 0.16 Allowed 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 121.918 0.866 . . . . 0.0 110.425 -179.447 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.482 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 96.1 mt -133.12 100.27 4.82 Favored 'General case' 0 C--N 1.278 -2.511 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -83.6 -72.68 0.45 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 114.44 -1.255 . . . . 0.0 112.036 -171.203 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -9.02 50.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 -179.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.516 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 0.7 OUTLIER -70.79 57.67 0.2 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 125.152 1.381 . . . . 0.0 113.957 -177.524 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -54.95 -40.59 70.11 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 123.572 0.749 . . . . 0.0 111.321 178.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -63.39 -44.96 93.2 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.516 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 26.8 m -62.68 -39.06 92.76 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.208 0.203 . . . . 0.0 111.365 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . 0.432 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 61.6 t80 -56.02 -49.64 73.12 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 176.586 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.9 -31.71 66.67 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.941 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -68.58 -37.71 80.09 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.951 0.9 . . . . 0.0 111.571 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -84.67 -23.66 29.32 Favored 'General case' 0 N--CA 1.413 -2.298 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.21 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . 0.432 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.1 OUTLIER -65.12 -46.11 82.32 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 176.213 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.38 -6.91 56.58 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.273 0.559 . . . . 0.0 111.247 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 36.8 t -78.8 -18.4 54.18 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 37.7 t -129.03 98.09 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.93 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.865 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -99.25 -6.75 27.5 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 171.552 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -88.45 18.87 4.18 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 127.212 2.205 . . . . 0.0 109.62 177.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -61.16 -0.62 0.36 Allowed 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 -172.868 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -75.75 -12.91 60.27 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 175.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -77.36 -12.84 60.0 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 114.297 -1.319 . . . . 0.0 110.941 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 14.1 p -54.98 133.49 48.46 Favored 'General case' 0 CA--C 1.485 -1.546 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -170.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 43.4 t-20 -73.73 137.9 44.29 Favored 'General case' 0 N--CA 1.413 -2.282 0 N-CA-C 104.551 -2.388 . . . . 0.0 104.551 170.663 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . 0.437 ' O ' ' HD1' ' A' ' 506' ' ' TYR . 46.4 tt0 -62.23 -18.58 61.54 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 118.858 0.754 . . . . 0.0 110.985 -172.825 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -60.36 -41.98 94.81 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.054 175.566 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -63.56 -36.71 84.7 Favored 'General case' 0 C--O 1.209 -1.029 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.229 174.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.416 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 1.2 tmtp? -64.11 -36.07 82.83 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.074 -175.855 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.547 ' O ' HG21 ' A' ' 510' ' ' VAL . 45.6 m-85 -60.3 -54.09 49.87 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.964 172.022 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.82 -48.22 88.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.593 -177.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -49.82 -49.9 47.22 Favored 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 123.363 0.414 . . . . 0.0 111.636 176.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -57.92 -49.11 77.88 Favored 'General case' 0 N--CA 1.461 0.123 0 O-C-N 123.698 0.624 . . . . 0.0 110.413 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.547 HG21 ' O ' ' A' ' 506' ' ' TYR . 60.2 t -55.36 -58.85 3.3 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.561 0 O-C-N 123.786 0.679 . . . . 0.0 110.707 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 9.5 mp -66.27 -44.5 83.41 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.04 -175.263 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 50.9 t-80 -62.17 -53.06 60.66 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.977 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.4 -29.32 63.63 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -173.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 21.7 m-30 -76.68 -47.55 21.7 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.659 177.712 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER -52.3 -43.55 64.54 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.591 1.156 . . . . 0.0 109.466 176.246 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -68.65 -9.61 51.09 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -121.49 -48.23 2.19 Favored 'General case' 0 C--N 1.313 -1.014 0 O-C-N 121.917 -0.49 . . . . 0.0 111.694 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -121.16 -151.01 0.47 Allowed 'General case' 0 C--N 1.29 -1.984 0 C-N-CA 123.563 0.745 . . . . 0.0 109.386 -177.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.84 -160.62 0.16 Allowed 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -75.56 179.83 5.08 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.988 -0.445 . . . . 0.0 110.173 -178.251 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -88.55 138.35 31.5 Favored 'General case' 0 N--CA 1.384 -3.729 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -176.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -119.29 175.8 5.63 Favored 'General case' 0 C--N 1.286 -2.183 0 CA-C-N 116.946 -0.115 . . . . 0.0 110.796 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 35.0 pt -68.73 -18.56 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.302 0.573 . . . . 0.0 110.992 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.477 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 3.5 p -59.71 -41.33 90.58 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-O 121.787 0.803 . . . . 0.0 109.741 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 40.9 m-20 -66.82 -36.91 83.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.001 -179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -59.8 -49.57 77.19 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.273 178.036 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.421 ' O ' ' HB ' ' A' ' 530' ' ' VAL . 9.5 p -68.15 -23.62 28.98 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.721 0 CA-C-O 120.903 0.382 . . . . 0.0 110.909 179.627 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . 0.477 ' HG3' ' O ' ' A' ' 524' ' ' SER . 26.6 mt-30 -67.28 -30.37 70.22 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 173.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.454 ' C ' ' H ' ' A' ' 531' ' ' ASN . 0.3 OUTLIER -83.17 16.59 2.35 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 173.497 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.421 ' HB ' ' O ' ' A' ' 527' ' ' VAL . 5.2 p -71.63 18.89 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 CA-C-O 121.928 0.871 . . . . 0.0 111.729 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . 0.454 ' H ' ' C ' ' A' ' 529' ' ' TYR . 10.4 p30 -107.86 -26.16 10.88 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.579 -0.701 . . . . 0.0 111.036 -178.611 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 24.8 m -92.2 140.03 30.03 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 179.467 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . 0.545 ' O ' ' HG2' ' A' ' 537' ' ' GLU . 19.3 m120 -57.84 -72.23 0.09 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -170.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -66.39 -32.45 73.85 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 120.67 0.271 . . . . 0.0 111.158 -174.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.428 ' O ' ' HB3' ' A' ' 539' ' ' LEU . 3.7 mm? -61.88 -50.51 71.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.391 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 48.4 ttt180 -62.3 -61.53 2.39 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.869 178.501 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . 0.545 ' HG2' ' O ' ' A' ' 533' ' ' ASN . 12.7 pt-20 -61.22 -62.27 1.96 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -173.207 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.463 ' O ' HD11 ' A' ' 542' ' ' LEU . 75.7 m -65.27 -53.77 39.21 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . 0.428 ' HB3' ' O ' ' A' ' 535' ' ' LEU . 47.4 tp -61.38 -44.03 97.85 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.468 -174.697 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 57.2 mt -68.18 -34.83 68.68 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.492 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 28.7 t -57.35 -49.22 76.84 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 121.555 0.693 . . . . 0.0 109.477 174.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.463 HD11 ' O ' ' A' ' 538' ' ' THR . 6.5 mp -66.96 -24.41 66.05 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.979 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . 0.523 ' HA ' ' CG ' ' A' ' 479' ' ' HIS . 0.9 OUTLIER -81.42 -64.7 1.13 Allowed 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.04 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -71.67 -59.59 2.68 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.857 -171.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -73.04 90.28 1.5 Allowed 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -173.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -137.26 100.17 4.18 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 173.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 5.5 tt -92.35 -82.54 0.32 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 118.589 -1.244 . . . . 0.0 111.518 -173.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -104.66 -48.99 3.64 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-O 121.743 0.782 . . . . 0.0 112.137 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -68.23 36.25 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 126.842 2.057 . . . . 0.0 113.824 -172.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -54.97 106.11 0.62 Allowed Pre-proline 0 C--O 1.244 0.798 0 C-N-CA 123.479 0.711 . . . . 0.0 112.174 -179.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 43.6 Cg_endo -92.72 111.55 0.24 Allowed 'Trans proline' 0 N--CA 1.426 -2.443 0 C-N-CA 122.596 2.197 . . . . 0.0 114.389 -173.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -131.26 -54.14 1.03 Allowed 'General case' 0 CA--C 1.494 -1.209 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 172.266 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -75.02 -50.22 17.23 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 113.853 -1.521 . . . . 0.0 108.585 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -67.1 -24.16 65.91 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 114.27 -1.332 . . . . 0.0 109.052 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . 0.403 ' CD ' ' HB1' ' A' ' 475' ' ' ALA . 6.1 tp10 -68.07 -56.61 8.25 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.58 -177.237 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 72.8 mt -54.71 -40.92 53.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.21 -51.67 68.79 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.431 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -66.16 -49.45 67.34 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.192 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.581 ' O ' HG12 ' A' ' 563' ' ' ILE . 87.5 t80 -51.49 -53.44 37.37 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 125.352 1.461 . . . . 0.0 110.233 178.644 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 75.7 t -61.41 -45.92 97.64 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.985 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -58.46 -39.72 80.68 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.741 0.416 . . . . 0.0 111.324 -179.426 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 76.3 t -70.12 -34.87 61.05 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 123.187 0.595 . . . . 0.0 112.246 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.581 HG12 ' O ' ' A' ' 559' ' ' TYR . 47.7 mm -86.37 -38.32 12.42 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -174.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . 0.418 ' HA ' ' HA3' ' A' ' 567' ' ' GLY . 53.7 t30 -76.82 0.14 21.83 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 113.956 -1.475 . . . . 0.0 109.646 178.624 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -64.54 -36.17 83.35 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 104.781 -2.303 . . . . 0.0 104.781 173.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . 0.426 ' HG2' ' O ' ' A' ' 566' ' ' LYS . 54.1 tttm -116.0 25.9 10.37 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 113.525 -1.67 . . . . 0.0 108.27 -179.473 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . 0.418 ' HA3' ' HA ' ' A' ' 564' ' ' ASN . . . -99.39 73.13 0.5 Allowed Glycine 0 N--CA 1.424 -2.134 0 C-N-CA 120.001 -1.095 . . . . 0.0 114.479 -171.048 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -95.13 110.35 22.31 Favored 'General case' 0 C--N 1.288 -2.089 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.61 172.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 72.02 152.88 0.12 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.185 1.394 . . . . 0.0 110.332 -173.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 31.7 m 71.29 -60.21 0.52 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.947 1.299 . . . . 0.0 111.236 -177.168 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . 0.451 ' O ' ' HB2' ' A' ' 574' ' ' LEU . 4.7 mm -75.15 -22.9 16.95 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.903 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 -177.386 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . 0.492 ' O ' ' HB3' ' A' ' 575' ' ' ASN . 56.4 mt-10 -71.22 -15.89 62.48 Favored 'General case' 0 N--CA 1.422 -1.861 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.079 178.728 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 47.1 t -68.46 -36.78 79.47 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 171.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . 0.451 ' HB2' ' O ' ' A' ' 571' ' ' ILE . 7.8 mp -65.36 -16.79 63.96 Favored 'General case' 0 C--O 1.206 -1.23 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.165 175.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . 0.492 ' HB3' ' O ' ' A' ' 572' ' ' GLU . 21.2 t-20 -58.36 -46.99 85.23 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 170.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . 0.524 2.8 p80 -68.31 -34.22 75.75 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 173.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . 0.545 ' O ' ' HB3' ' A' ' 580' ' ' GLU . 0.3 OUTLIER -65.21 -32.43 74.11 Favored 'General case' 0 CA--C 1.564 1.504 0 CA-C-O 121.14 0.495 . . . . 0.0 110.371 174.697 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 40.6 tp -57.02 -46.14 82.56 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.643 ' HD3' ' O ' ' A' ' 579' ' ' ARG . 0.0 OUTLIER -60.18 -36.77 78.34 Favored 'General case' 0 CA--C 1.562 1.413 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.924 175.73 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . 0.599 ' O ' ' HG2' ' A' ' 583' ' ' ARG . 26.1 tt0 -60.06 -50.55 73.28 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 123.362 0.665 . . . . 0.0 110.677 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -60.07 -44.85 94.45 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.618 0.723 . . . . 0.0 111.002 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.509 ' HB ' ' CB ' ' A' ' 588' ' ' GLU . 40.2 p -69.77 -25.2 63.69 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 -175.516 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.599 ' HG2' ' O ' ' A' ' 580' ' ' GLU . 6.7 ptp180 -51.12 -2.91 0.02 OUTLIER 'General case' 0 N--CA 1.513 2.693 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 -176.216 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 31.2 pt -74.95 -3.4 4.71 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -173.111 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 120.95 -0.83 11.85 Favored Glycine 0 N--CA 1.476 1.351 0 C-N-CA 118.6 -1.762 . . . . 0.0 115.082 172.089 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -74.8 165.63 24.93 Favored 'General case' 0 C--N 1.298 -1.645 0 C-N-CA 122.986 0.514 . . . . 0.0 110.334 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.575 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 13.5 t -56.92 -5.15 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.156 0 C-N-CA 125.79 1.636 . . . . 0.0 110.166 177.6 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.509 ' CB ' ' HB ' ' A' ' 582' ' ' THR . 8.9 mm-40 -61.09 -15.04 28.46 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 123.299 0.64 . . . . 0.0 109.596 169.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . 0.528 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 65.3 tp -70.53 -35.26 73.07 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.336 -0.986 . . . . 0.0 108.336 171.501 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . 0.575 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 6.6 tp-100 -61.48 -39.08 89.61 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 172.19 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.52 ' O ' ' HB3' ' A' ' 594' ' ' LEU . 98.6 mttt -72.16 -23.4 61.28 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.83 174.417 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.528 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 43.8 t80 -58.38 -40.01 81.17 Favored 'General case' 0 C--O 1.211 -0.927 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 173.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -52.31 -48.63 65.29 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 173.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . 0.52 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 15.6 tp -59.49 -52.87 63.72 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.566 0.746 . . . . 0.0 110.249 176.153 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . 0.412 ' NE2' ' HB3' ' A' ' 599' ' ' ALA . 22.7 tm0? -62.4 -38.24 88.9 Favored 'General case' 0 C--O 1.202 -1.418 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.373 -174.452 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 23.6 tp60 -62.45 -42.69 99.65 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.379 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 87.8 mt -58.98 -50.67 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 123.613 0.57 . . . . 0.0 110.534 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 70.1 t -65.35 -41.68 91.85 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.448 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.059 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . 0.412 ' HB3' ' NE2' ' A' ' 595' ' ' GLN . . . -64.27 -34.13 77.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.001 0.429 . . . . 0.0 110.335 176.968 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 21.7 tptt -65.54 -46.87 77.89 Favored 'General case' 0 C--O 1.208 -1.127 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 176.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . 0.435 ' HA ' ' HD2' ' A' ' 604' ' ' ARG . 78.8 m-20 -67.23 -28.27 67.92 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.598 177.946 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.455 ' HG3' ' HG3' ' A' ' 603' ' ' GLU . 0.4 OUTLIER -67.64 -65.72 0.65 Allowed 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.025 175.317 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . 0.455 ' HG3' ' HG3' ' A' ' 602' ' ' LYS . 52.2 mt-10 -89.33 19.35 4.46 Favored 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -173.79 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . 0.435 ' HD2' ' HA ' ' A' ' 601' ' ' ASN . 15.9 ptm180 -72.83 -7.99 53.41 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.567 0.698 . . . . 0.0 109.654 172.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 60.3 ttp . . . . . 0 N--CA 1.423 -1.79 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.023 179.165 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 12.7 p90 . . . . . 0 N--CA 1.446 -0.665 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -70.45 153.08 43.33 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.579 0.228 . . . . 0.0 111.512 -177.526 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -91.64 47.82 1.4 Allowed 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -178.296 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.23 95.12 0.4 Allowed 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.385 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 67.2 p -101.94 -177.84 3.53 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.191 -174.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.3 ptt180 -69.36 -18.19 63.76 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.235 173.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 98.6 mt-30 -57.54 -67.62 0.31 Allowed 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 -168.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.464 ' O ' ' HG3' ' A' ' 474' ' ' ARG 0.449 11.7 pt-20 -77.1 -9.06 58.49 Favored 'General case' 0 N--CA 1.421 -1.887 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -177.957 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -67.07 -44.46 80.03 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 170.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -67.86 -27.78 66.98 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.768 0.794 . . . . 0.0 109.184 176.256 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . 0.427 ' CB ' ' HA ' ' A' ' 470' ' ' GLU . 0.1 OUTLIER -70.18 -45.14 67.3 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 114.67 -1.15 . . . . 0.0 108.541 177.801 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.464 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 67.7 mtt180 -57.06 -35.31 69.19 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.19 0.519 . . . . 0.0 110.89 172.364 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -69.5 -39.35 77.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.591 175.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . 0.54 ' O ' ' HB2' ' A' ' 479' ' ' HIS . 4.2 t80 -64.49 -38.39 90.84 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 123.69 0.796 . . . . 0.0 110.097 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 56.3 tp -63.47 -43.35 97.57 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.44 1.096 . . . . 0.0 111.162 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -74.61 -53.37 9.49 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . 0.54 ' HB2' ' O ' ' A' ' 476' ' ' PHE . 1.7 t-80 40.05 -97.15 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.096 2.159 . . . . 0.0 113.326 177.292 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.428 ' H ' ' HB3' ' A' ' 479' ' ' HIS . 3.2 mm? -136.27 153.24 51.25 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 173.648 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' MET . . . . . 0.556 ' HG3' ' O ' ' A' ' 521' ' ' TYR . 58.7 ttp -54.29 -34.98 62.09 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 122.987 0.515 . . . . 0.0 112.316 -177.414 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 19.7 ptt-85 -66.83 -17.49 64.91 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -177.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.404 ' HB2' ' O ' ' A' ' 480' ' ' LEU . 4.6 m-20 -70.55 41.28 0.06 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 116.505 2.039 . . . . 0.0 116.505 -169.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . 0.571 ' HD2' ' CD2' ' A' ' 515' ' ' TYR . 30.6 mmtp -60.88 -42.77 98.59 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-O 121.136 0.493 . . . . 0.0 110.983 174.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -60.93 -50.41 73.52 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.093 178.534 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 59.3 m -58.32 -43.05 88.03 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 123.952 0.901 . . . . 0.0 111.266 179.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . 0.501 ' CE1' ' HB3' ' A' ' 511' ' ' LEU . 82.5 t80 -46.19 -55.35 7.23 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.748 1.219 . . . . 0.0 109.893 175.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 60.0 mt -79.02 -27.36 43.23 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.138 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -67.07 -41.31 86.64 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.82 -38.7 20.9 Favored 'General case' 0 N--CA 1.424 -1.764 0 C-N-CA 120.116 -0.634 . . . . 0.0 109.786 -177.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 28.9 t80 -55.14 -58.2 8.64 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -77.82 -14.38 59.59 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 120.372 -0.531 . . . . 0.0 112.221 -170.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 43.5 m -82.31 -60.99 2.02 Favored 'General case' 0 N--CA 1.425 -1.68 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -173.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . 0.425 HG11 ' O ' ' A' ' 495' ' ' ASP . 87.6 t -139.14 134.97 41.71 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 120.353 -0.539 . . . . 0.0 112.125 -167.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . 0.425 ' O ' HG11 ' A' ' 494' ' ' VAL . 12.0 m-20 -85.87 158.95 19.82 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 170.85 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -89.23 -90.89 0.13 Allowed 'General case' 0 CA--C 1.5 -0.962 0 C-N-CA 116.459 -2.096 . . . . 0.0 112.152 -167.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -106.25 -85.22 0.5 Allowed 'General case' 0 N--CA 1.431 -1.375 0 C-N-CA 114.444 -2.903 . . . . 0.0 113.02 171.059 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -127.79 -50.67 1.36 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.524 1.53 . . . . 0.0 114.991 171.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . 0.357 10.8 p90 -70.57 -93.15 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.831 1 N-CA-C 123.904 4.779 . . . . 0.0 123.904 -149.646 . . . . . . . . 3 2 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 11.4 m -93.45 89.7 6.42 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -161.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -127.25 42.02 3.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 117.769 -1.573 . . . . 0.0 114.227 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . 0.421 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 1.1 tm0? -90.13 -35.06 15.63 Favored 'General case' 0 CA--C 1.502 -0.902 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 168.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . 0.718 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 87.3 m-70 -62.86 -40.64 98.11 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.111 -178.42 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . 0.456 ' O ' ' HD2' ' A' ' 508' ' ' PHE . 37.2 m-85 -63.85 -40.78 97.37 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.169 175.366 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.421 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 54.2 tttp -58.77 -50.36 74.21 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 123.688 0.795 . . . . 0.0 109.7 -175.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.718 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.279 9.8 p90 -65.02 -36.62 84.98 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 118.261 -1.375 . . . . 0.0 113.265 178.997 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.85 -48.75 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 120.311 -0.555 . . . . 0.0 109.802 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . 0.456 ' HD2' ' O ' ' A' ' 504' ' ' PHE . 32.3 m-85 -51.79 -39.39 58.57 Favored 'General case' 0 CA--C 1.499 -0.998 0 O-C-N 123.826 0.704 . . . . 0.0 112.637 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -58.39 -61.17 2.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.747 0.654 . . . . 0.0 109.512 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.417 HG22 ' O ' ' A' ' 506' ' ' TYR . 32.0 t -58.29 -48.94 83.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.389 -176.778 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.501 ' HB3' ' CE1' ' A' ' 487' ' ' PHE . 2.9 tt -68.61 -40.83 80.23 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.802 -172.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -70.09 -35.11 73.94 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.89 -49.16 77.33 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.172 0.589 . . . . 0.0 110.427 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -63.45 -44.13 95.38 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.952 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . 0.571 ' CD2' ' HD2' ' A' ' 484' ' ' LYS . 0.7 OUTLIER -52.98 -42.32 65.43 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 124.142 0.977 . . . . 0.0 109.773 179.641 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.84 -21.34 63.38 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -116.03 -53.85 2.53 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-O 121.87 0.843 . . . . 0.0 112.198 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . 0.556 ' CG ' ' H ' ' A' ' 519' ' ' ASP . 22.8 t-20 -101.88 -152.36 0.44 Allowed 'General case' 0 C--N 1.281 -2.38 0 CA-C-N 114.161 -1.381 . . . . 0.0 110.248 -169.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . 0.556 ' H ' ' CG ' ' A' ' 518' ' ' ASN . 29.1 t70 -106.17 -158.15 0.64 Allowed 'General case' 0 C--N 1.272 -2.78 0 C-N-CA 128.505 2.722 . . . . 0.0 105.664 -170.619 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . 0.471 ' HA ' ' NZ ' ' A' ' 484' ' ' LYS 0.412 3.5 pm0 -62.95 155.08 28.38 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 120.501 1.501 . . . . 0.0 112.71 178.25 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . 0.556 ' O ' ' HG3' ' A' ' 481' ' ' MET . 0.3 OUTLIER -84.06 131.46 34.8 Favored 'General case' 0 N--CA 1.397 -3.101 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -167.006 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -72.38 146.51 46.99 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.014 -178.451 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . 0.45 ' HB ' ' OE2' ' A' ' 543' ' ' GLU . 39.1 pt -84.29 -12.02 11.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.483 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 35.7 t -56.84 -38.54 72.8 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.869 175.644 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -64.62 -34.45 78.3 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . 0.516 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -61.95 -39.6 92.66 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.114 176.802 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 56.5 t -71.17 -37.22 65.65 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.115 0 C-N-CA 124.083 0.953 . . . . 0.0 108.729 177.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . 0.483 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.2 mm100 -67.3 -10.48 51.3 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 122.711 0.405 . . . . 0.0 111.119 178.146 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.516 ' HB2' ' O ' ' A' ' 526' ' ' ALA . 4.9 m-85 -71.13 -0.02 8.72 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.645 168.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.518 ' HA ' ' CB ' ' A' ' 536' ' ' ARG . 6.3 p -73.03 15.27 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.642 0 CA-C-O 122.288 1.042 . . . . 0.0 110.469 174.31 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . 0.452 ' H ' ' C ' ' A' ' 529' ' ' TYR . 5.9 t30 -97.12 -24.8 15.58 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 174.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 31.8 t -91.75 141.68 28.41 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 114.963 -1.017 . . . . 0.0 108.785 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -65.86 -51.04 62.17 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -175.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -94.95 -37.83 10.97 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.145 0.498 . . . . 0.0 111.204 -177.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.404 HD22 ' OH ' ' A' ' 506' ' ' TYR . 45.8 mt -66.32 -21.49 66.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.708 -174.135 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . 0.518 ' CB ' ' HA ' ' A' ' 530' ' ' VAL . 36.3 ptt180 -63.47 -46.42 86.29 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.21 -49.85 75.47 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.525 -178.061 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.443 ' O ' ' HB2' ' A' ' 541' ' ' SER . 5.7 m -61.01 -54.52 43.95 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -178.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . 0.31 4.2 mm? -65.28 -35.62 81.58 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -177.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 72.1 mt -72.0 -29.64 33.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.91 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' SER . . . . . 0.443 ' HB2' ' O ' ' A' ' 538' ' ' THR . 73.3 m -57.41 -40.76 78.99 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.669 0.747 . . . . 0.0 109.544 168.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -74.67 -13.08 60.58 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 174.054 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . 0.45 ' OE2' ' HB ' ' A' ' 523' ' ' ILE . 53.9 mm-40 -80.47 -40.75 25.63 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.246 0.546 . . . . 0.0 111.146 174.75 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -77.58 27.36 0.17 Allowed 'General case' 0 CA--C 1.557 1.224 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -176.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -67.84 163.7 21.31 Favored 'General case' 0 C--O 1.242 0.705 0 O-C-N 122.237 -0.289 . . . . 0.0 110.688 177.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . 0.419 ' C ' ' H ' ' A' ' 548' ' ' ASN . 46.3 m-80 -93.1 155.02 17.76 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.876 -0.329 . . . . 0.0 111.307 -177.1 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . 0.409 ' C ' ' H ' ' A' ' 549' ' ' ASP . 88.2 mt -77.47 22.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.431 1.092 . . . . 0.0 111.952 -179.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . 0.473 ' C ' ' H ' ' A' ' 550' ' ' GLU . 2.6 t-20 -79.8 21.32 0.55 Allowed 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 122.082 0.944 . . . . 0.0 110.183 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . 0.409 ' H ' ' C ' ' A' ' 547' ' ' LEU . 5.2 p-10 -70.08 9.65 0.53 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 125.601 1.56 . . . . 0.0 111.626 178.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.473 ' H ' ' C ' ' A' ' 548' ' ' ASN . 34.9 mt-10 -54.9 154.66 9.33 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 125.917 1.687 . . . . 0.0 111.873 -175.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -71.83 45.16 0.7 Allowed 'Trans proline' 0 N--CA 1.503 2.033 0 C-N-CA 124.666 3.577 . . . . 0.0 112.807 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -134.92 50.49 2.16 Favored 'General case' 0 C--N 1.282 -2.334 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 178.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -56.66 67.35 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 117.153 2.279 . . . . 0.0 117.153 -169.679 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . 0.454 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 7.6 t30 -70.65 -22.08 62.54 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.919 1.287 . . . . 0.0 107.786 171.275 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -44.93 -54.53 6.39 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.537 1.535 . . . . 0.0 110.029 177.043 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 54.6 mt -62.7 -38.86 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.396 0.678 . . . . 0.0 110.284 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . 0.454 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 3.2 t70 -56.57 -51.25 69.32 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 121.071 0.462 . . . . 0.0 110.611 177.416 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . 0.495 ' O ' HG22 ' A' ' 562' ' ' VAL . 29.6 t70 -67.13 -47.41 71.17 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.999 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.433 ' O ' HD13 ' A' ' 563' ' ' ILE . 77.6 t80 -51.99 -53.37 42.48 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.998 1.319 . . . . 0.0 111.456 179.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.28 -44.24 95.26 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.679 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . 0.471 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 9.3 t30 -63.09 -36.33 83.22 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 122.774 0.43 . . . . 0.0 112.143 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . 0.495 HG22 ' O ' ' A' ' 558' ' ' ASP . 89.7 t -70.97 -50.3 43.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-O 121.591 0.71 . . . . 0.0 111.493 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.538 ' O ' ' HG3' ' A' ' 566' ' ' LYS . 1.7 mp -80.7 -55.5 8.34 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.882 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.465 -168.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -74.57 1.09 12.88 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 122.091 0.948 . . . . 0.0 111.041 -173.265 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.471 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 45.2 tt0 -67.2 -14.71 63.17 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 169.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . 0.538 ' HG3' ' O ' ' A' ' 563' ' ' ILE . 0.1 OUTLIER -58.11 -18.4 24.83 Favored 'General case' 0 C--N 1.357 0.931 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.781 173.547 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . 119.31 123.29 3.15 Favored Glycine 0 N--CA 1.426 -1.967 0 C-N-CA 120.169 -1.015 . . . . 0.0 113.112 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -164.74 -86.2 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 173.905 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -107.71 -173.08 2.2 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.799 -0.182 . . . . 0.0 110.664 -177.911 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 570' ' ' THR . . . . . 0.452 HG23 ' N ' ' A' ' 571' ' ' ILE . 42.5 m -88.96 161.59 16.54 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -178.658 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . 0.48 ' HA ' HD13 ' A' ' 574' ' ' LEU . 18.4 tt -53.65 -38.12 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.086 0 C-N-CA 123.695 0.798 . . . . 0.0 112.879 -179.465 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 35.9 mt-10 -75.04 -32.51 61.57 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.611 0.72 . . . . 0.0 110.318 -176.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 9.7 m -66.1 -39.48 90.01 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 176.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . 0.544 ' O ' ' HG ' ' A' ' 578' ' ' LEU . 59.0 mt -58.97 -43.39 91.33 Favored 'General case' 0 C--O 1.205 -1.269 0 CA-C-N 115.034 -0.985 . . . . 0.0 109.153 175.443 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 13.8 m120 -51.93 -48.72 64.1 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.806 0.691 . . . . 0.0 111.496 -177.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -63.32 -40.66 97.93 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.933 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -66.85 -41.96 86.51 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.301 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.544 ' HG ' ' O ' ' A' ' 574' ' ' LEU . 88.2 mt -54.99 -57.26 12.39 Favored 'General case' 0 CA--C 1.482 -1.647 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.515 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.589 ' CB ' ' HB3' ' A' ' 593' ' ' TYR . 0.2 OUTLIER -62.39 -25.73 68.09 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.719 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . 0.485 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 34.3 tt0 -68.9 -39.53 79.68 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 175.169 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -65.84 -47.87 73.53 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.103 0.478 . . . . 0.0 110.502 174.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.447 ' C ' ' H ' ' A' ' 584' ' ' ILE . 14.3 m -60.9 -25.53 66.8 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.822 1.249 . . . . 0.0 112.041 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.485 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 6.6 tpm_? -48.11 -6.99 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.757 0 C-N-CA 126.437 1.895 . . . . 0.0 113.102 174.982 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . 0.447 ' H ' ' C ' ' A' ' 582' ' ' THR . 16.4 tt -70.16 -18.19 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 123.612 0.765 . . . . 0.0 111.887 -177.329 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 127.54 16.48 2.28 Favored Glycine 0 CA--C 1.533 1.177 0 N-CA-C 118.879 2.312 . . . . 0.0 118.879 171.302 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -85.08 109.08 17.98 Favored 'General case' 0 C--O 1.2 -1.534 0 CA-C-N 119.879 1.839 . . . . 0.0 107.231 170.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.1 p -53.87 -43.24 56.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -171.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -66.95 -55.76 13.17 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-O 121.096 0.474 . . . . 0.0 110.568 -176.226 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . 0.403 ' O ' ' HB2' ' A' ' 593' ' ' TYR . 4.3 mm? -69.54 -34.2 73.87 Favored 'General case' 0 C--O 1.198 -1.649 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.661 -178.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . 0.554 ' O ' ' HG ' ' A' ' 594' ' ' LEU . 29.5 tt0 -58.5 -47.79 82.95 Favored 'General case' 0 C--O 1.198 -1.637 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -62.76 -46.09 89.64 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.527 0.68 . . . . 0.0 109.798 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.663 ' O ' ' HB2' ' A' ' 595' ' ' GLN . 73.6 t80 -56.58 -50.5 71.75 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 124.042 1.877 . . . . 0.0 108.821 176.23 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . 0.589 ' HB3' ' CB ' ' A' ' 579' ' ' ARG 0.307 18.6 m-85 -67.19 -27.69 67.48 Favored 'General case' 0 C--N 1.247 -3.88 0 N-CA-C 114.471 1.285 . . . . 0.0 114.471 177.888 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . 0.624 ' O ' ' HB ' ' A' ' 597' ' ' ILE 0.315 12.1 mt -69.3 -19.85 63.9 Favored 'General case' 0 C--N 1.293 -1.86 0 O-C-N 120.118 -1.614 . . . . 0.0 111.937 174.313 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . 0.663 ' HB2' ' O ' ' A' ' 592' ' ' TYR 0.289 42.6 mt-30 -61.68 -40.91 96.64 Favored 'General case' 0 CA--C 1.482 -1.671 0 N-CA-C 107.667 -1.235 . . . . 0.0 107.667 164.763 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . 0.401 ' CB ' ' HG2' ' A' ' 579' ' ' ARG . 2.3 mp0 -63.95 -16.49 61.63 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.026 174.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . 0.624 ' HB ' ' O ' ' A' ' 594' ' ' LEU . 48.2 mt -60.5 -46.86 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.523 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 164.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . 0.424 ' HB ' ' O ' ' A' ' 595' ' ' GLN . 59.0 t -62.38 -35.41 69.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.72 175.582 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . 0.684 ' O ' ' HG2' ' A' ' 602' ' ' LYS . . . -64.42 -29.8 70.85 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.091 0.472 . . . . 0.0 111.211 173.743 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -66.44 -36.21 82.23 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 174.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -68.88 -36.39 78.01 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.754 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.684 ' HG2' ' O ' ' A' ' 599' ' ' ALA . 51.5 pttt -69.31 -27.19 65.17 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.093 0.473 . . . . 0.0 109.797 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -75.08 -39.96 60.41 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.721 0.772 . . . . 0.0 109.172 175.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -73.07 -35.24 66.62 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.355 -178.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 21.4 ttt . . . . . 0 C--N 1.291 -1.949 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 -177.173 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 1.8 p90 . . . . . 0 N--CA 1.429 -1.502 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -82.51 146.55 29.17 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 175.707 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -92.71 46.51 1.24 Allowed 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.199 1.0 . . . . 0.0 110.531 -177.276 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 91.5 mt -66.83 102.73 0.99 Allowed 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 113.995 -1.457 . . . . 0.0 111.505 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 41.0 t -109.53 104.16 13.17 Favored 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 173.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -70.81 -29.13 65.22 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.551 -0.46 . . . . 0.0 112.2 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -67.65 -54.3 20.77 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.057 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.62 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 32.0 tt0 -63.48 -36.67 84.51 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -58.18 -42.43 86.06 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.483 177.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -65.65 -43.43 89.42 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.089 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.72 -44.5 93.7 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.457 0.703 . . . . 0.0 110.924 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.62 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 92.4 mtt180 -53.46 -54.27 39.4 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.296 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . 0.426 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -69.56 -43.47 72.83 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 124.146 0.903 . . . . 0.0 112.265 -178.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -55.12 -36.65 65.95 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.019 0.927 . . . . 0.0 111.727 -176.041 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . 0.402 HD13 HG13 ' A' ' 507' ' ' VAL . 1.2 tm? -57.38 -31.34 65.7 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 113.866 -1.516 . . . . 0.0 111.277 -176.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.465 ' HD3' ' O ' ' A' ' 542' ' ' LEU . 12.4 pttt -71.65 -19.87 62.03 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -172.61 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . 0.401 ' N ' ' HG3' ' A' ' 478' ' ' LYS . 9.0 t-160 -119.92 9.09 11.18 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 118.239 -1.384 . . . . 0.0 112.832 -171.825 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.435 ' HB2' HG23 ' A' ' 486' ' ' THR 0.264 1.1 pp -91.58 72.07 5.91 Favored 'General case' 0 C--O 1.194 -1.83 0 CA-C-O 122.739 1.256 . . . . 0.0 110.982 175.812 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -98.67 9.45 43.29 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . 0.644 ' O ' ' HG2' ' A' ' 520' ' ' GLN . 97.7 mtt180 -66.56 -97.8 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 119.946 1.248 . . . . 0.0 114.282 -171.16 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . 0.278 1.1 p30 -143.64 -84.87 0.15 Allowed 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.034 2.235 . . . . 0.0 117.034 168.354 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt -95.43 -41.3 9.05 Favored 'General case' 0 CA--C 1.485 -1.551 0 CA-C-O 121.893 0.854 . . . . 0.0 109.414 -178.382 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . 0.454 ' O ' ' HB2' ' A' ' 489' ' ' ASN . 9.7 p-10 -51.1 -38.4 51.6 Favored 'General case' 0 C--O 1.173 -2.965 0 CA-C-N 112.683 -2.053 . . . . 0.0 109.211 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.435 HG23 ' HB2' ' A' ' 480' ' ' LEU . 3.1 m -59.05 -51.44 70.03 Favored 'General case' 0 N--CA 1.419 -1.98 0 C-N-CA 125.907 1.683 . . . . 0.0 113.343 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -66.13 -44.72 83.44 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -174.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 59.4 mt -76.33 -21.75 55.8 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.356 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . 0.454 ' HB2' ' O ' ' A' ' 485' ' ' ASP . 57.7 t30 -65.6 -40.39 92.59 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 123.008 0.523 . . . . 0.0 109.97 -177.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -83.96 -54.31 4.96 Favored 'General case' 0 N--CA 1.425 -1.704 0 C-N-CA 119.19 -1.004 . . . . 0.0 109.749 175.844 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -58.92 -35.96 73.96 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -171.397 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -83.23 -23.14 32.89 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 121.347 0.594 . . . . 0.0 111.347 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 15.8 m -83.98 -41.67 17.06 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -175.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 40.0 t -101.87 161.73 3.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.361 -173.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.81 101.95 14.7 Favored 'General case' 0 CA--C 1.495 -1.169 0 CA-C-O 121.1 0.476 . . . . 0.0 111.352 177.404 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -57.99 -36.81 73.16 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.929 -176.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -73.74 -28.35 61.65 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -83.36 -56.64 3.64 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 121.744 0.783 . . . . 0.0 109.113 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -77.57 11.64 1.96 Allowed 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -174.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 5.1 m -52.5 99.88 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.753 0.787 . . . . 0.0 111.896 -173.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.46 ' HB3' ' CD2' ' A' ' 504' ' ' PHE . 23.2 t-20 -119.3 154.76 33.01 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 178.569 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 47.5 tp60 -58.99 -31.8 69.1 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 123.715 0.806 . . . . 0.0 110.312 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -59.01 -53.96 52.46 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 124.181 0.992 . . . . 0.0 108.685 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . 0.46 ' CD2' ' HB3' ' A' ' 501' ' ' ASN . 22.0 m-85 -66.42 -35.1 79.47 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.425 -178.209 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -64.36 -49.34 72.01 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 123.199 0.599 . . . . 0.0 110.269 -176.83 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.526 ' O ' HG21 ' A' ' 510' ' ' VAL . 9.2 m-85 -60.09 -54.87 40.81 Favored 'General case' 0 N--CA 1.439 -0.991 0 O-C-N 123.855 0.722 . . . . 0.0 111.953 178.477 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . 0.478 ' O ' ' HB2' ' A' ' 511' ' ' LEU . 54.5 t -60.48 -48.04 90.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.349 -176.961 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -49.69 -50.31 44.19 Favored 'General case' 0 C--O 1.218 -0.567 0 O-C-N 123.568 0.543 . . . . 0.0 111.117 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -63.46 -53.73 47.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.526 HG21 ' O ' ' A' ' 506' ' ' TYR . 42.8 t -57.96 -45.95 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 121.217 0.532 . . . . 0.0 110.407 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.478 ' HB2' ' O ' ' A' ' 507' ' ' VAL . 0.4 OUTLIER -66.4 -48.66 69.36 Favored 'General case' 0 N--CA 1.419 -2.001 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.976 -176.352 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -60.01 -42.96 95.45 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.152 0.581 . . . . 0.0 110.651 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -71.15 -43.34 67.73 Favored 'General case' 0 C--N 1.313 -0.991 0 O-C-N 123.405 0.441 . . . . 0.0 112.179 -173.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . 0.405 ' HA ' ' HG2' ' A' ' 517' ' ' GLU . 65.1 m-85 -73.92 -42.16 61.02 Favored 'General case' 0 C--O 1.199 -1.605 0 C-N-CA 119.289 -0.964 . . . . 0.0 111.607 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -54.74 -32.06 59.24 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.454 0.701 . . . . 0.0 110.311 176.702 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -70.23 -24.37 63.08 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.409 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . 0.405 ' HG2' ' HA ' ' A' ' 514' ' ' PHE . 10.0 pt-20 -110.03 -44.05 3.86 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -176.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . 0.441 ' HB3' ' H ' ' A' ' 519' ' ' ASP . 92.1 m-20 -135.38 -152.16 0.45 Allowed 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 124.355 1.062 . . . . 0.0 109.592 -172.622 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . 0.441 ' H ' ' HB3' ' A' ' 518' ' ' ASN . 3.4 p-10 -79.32 -164.54 0.64 Allowed 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 125.093 1.357 . . . . 0.0 111.683 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . 0.644 ' HG2' ' O ' ' A' ' 482' ' ' ARG . 0.0 OUTLIER -73.78 -178.79 3.33 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 115.933 1.827 . . . . 0.0 115.933 -171.227 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . 0.422 ' CB ' ' HG ' ' A' ' 511' ' ' LEU . 12.0 t80 -103.21 138.03 40.56 Favored 'General case' 1 N--CA 1.362 -4.863 0 C-N-CA 125.384 1.473 . . . . 0.0 107.49 -177.321 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -118.99 167.79 11.42 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.6 pp -70.36 -8.63 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 121.512 0.672 . . . . 0.0 110.726 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 12.8 m -56.19 -40.47 74.01 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.787 173.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -71.41 -40.51 70.42 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . 0.445 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -59.29 -48.11 82.86 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.878 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.657 ' O ' HG11 ' A' ' 530' ' ' VAL . 10.3 p -67.65 -28.55 42.19 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.854 0 CA-C-O 121.314 0.578 . . . . 0.0 110.71 177.463 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -70.7 -20.77 62.64 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.585 ' O ' ' HG2' ' A' ' 536' ' ' ARG . 2.0 m-85 -74.57 -23.41 58.76 Favored 'General case' 0 CA--C 1.494 -1.184 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.657 HG11 ' O ' ' A' ' 527' ' ' VAL . 10.0 p -74.03 52.57 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.898 0 CA-C-O 123.226 1.488 . . . . 0.0 114.839 -171.932 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -107.64 -34.14 7.09 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 173.483 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.54 144.79 25.43 Favored 'General case' 0 N--CA 1.424 -1.737 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 171.198 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . 0.257 7.2 p30 -76.34 -69.0 0.53 Allowed 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 -168.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . 0.258 0.0 OUTLIER -50.24 -73.16 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 117.479 2.4 . . . . 0.0 117.479 -164.911 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 58.8 tp -71.91 -31.98 66.94 Favored 'General case' 0 C--N 1.28 -2.453 0 CA-C-O 121.646 0.736 . . . . 0.0 111.236 -172.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . 0.585 ' HG2' ' O ' ' A' ' 529' ' ' TYR . 8.2 mpt_? -75.02 -44.0 50.48 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.34 -173.741 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -60.73 -40.21 91.5 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.31 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.481 ' O ' HD11 ' A' ' 542' ' ' LEU . 57.2 m -54.38 -49.14 70.56 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.908 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -59.17 -38.24 79.29 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 177.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 49.9 mm -68.29 -40.67 82.93 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 35.2 t -58.47 -45.46 88.61 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.696 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.481 HD11 ' O ' ' A' ' 538' ' ' THR . 6.8 mp -64.78 -30.08 71.07 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.959 177.958 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . 0.453 ' HA ' ' CD ' ' A' ' 478' ' ' LYS . 0.2 OUTLIER -76.29 -34.4 59.09 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 177.893 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -62.67 -36.11 81.83 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.374 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -67.67 113.39 5.42 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 172.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -134.52 103.08 5.54 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-O 121.962 0.887 . . . . 0.0 111.929 -178.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . 0.418 ' HG ' ' ND2' ' A' ' 554' ' ' ASN . 40.8 tp -91.85 -12.54 33.36 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.591 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -70.1 18.94 0.05 OUTLIER 'General case' 0 CA--C 1.559 1.31 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 -173.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -68.76 -31.39 70.39 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.65 0.738 . . . . 0.0 112.11 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.41 ' HB2' ' HD2' ' A' ' 551' ' ' PRO . 12.5 pt-20 -95.71 -178.97 0.84 Allowed Pre-proline 0 C--N 1.3 -1.582 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . 0.41 ' HD2' ' HB2' ' A' ' 550' ' ' GLU . 83.9 Cg_exo -47.6 137.85 19.89 Favored 'Trans proline' 0 C--N 1.386 2.527 0 C-N-CA 121.811 1.674 . . . . 0.0 110.299 175.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -74.01 4.73 5.04 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 121.908 0.861 . . . . 0.0 112.866 -167.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . 0.417 ' HA ' HG12 ' A' ' 556' ' ' ILE . 1.9 mp0 -74.94 -12.6 60.39 Favored 'General case' 0 N--CA 1.408 -2.565 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.859 176.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . 0.418 ' ND2' ' HG ' ' A' ' 547' ' ' LEU . 28.0 p-10 -69.75 -24.4 63.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.882 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -80.34 -56.38 4.24 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -177.304 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . 0.434 ' O ' HG13 ' A' ' 560' ' ' VAL . 34.0 pt -64.69 -38.24 82.16 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.87 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . 0.454 ' HA ' HH21 ' A' ' 579' ' ' ARG . 36.2 t70 -63.94 -45.08 90.77 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -65.37 -45.78 82.73 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -56.22 -52.58 63.92 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 113.985 -1.461 . . . . 0.0 111.291 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . 0.467 HG12 ' CE1' ' A' ' 576' ' ' HIS . 13.2 p -65.94 -36.01 76.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.353 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . 0.496 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 27.3 t-20 -62.55 -32.73 73.73 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.349 0.595 . . . . 0.0 110.232 176.529 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 70.2 t -77.35 -56.94 6.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 CA-C-N 115.553 -0.748 . . . . 0.0 112.522 175.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . . . . . . . . . 50.7 mm -74.77 -49.74 28.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.418 -169.301 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -80.78 -3.29 50.45 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.575 -174.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.496 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 29.4 tt0 -64.11 -32.75 74.43 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 168.685 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -103.22 30.0 5.18 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.046 174.754 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -125.59 -84.01 0.54 Allowed Glycine 0 N--CA 1.423 -2.208 0 C-N-CA 120.202 -0.999 . . . . 0.0 114.04 -174.795 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -139.89 -3.79 1.42 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -171.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -86.92 122.45 30.79 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 118.47 -1.292 . . . . 0.0 114.346 -172.537 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 7.5 t -137.9 -53.98 0.65 Allowed 'General case' 0 CA--C 1.561 1.375 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.704 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 11.5 tt -90.8 -38.34 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 CA-C-O 122.419 1.105 . . . . 0.0 108.358 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -74.95 -20.13 59.81 Favored 'General case' 0 C--O 1.196 -1.736 0 CA-C-N 114.038 -1.437 . . . . 0.0 111.243 179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 66.9 p -63.63 -31.34 72.48 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 69.6 mt -63.15 -55.25 26.8 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.142 -0.935 . . . . 0.0 108.785 175.056 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . 0.473 ' ND2' ' HB2' ' A' ' 601' ' ' ASN . 2.6 m-20 -62.84 -35.11 78.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.251 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . 0.467 ' CE1' HG12 ' A' ' 560' ' ' VAL . 20.9 t-160 -63.47 -34.94 78.86 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.259 176.84 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -60.52 -45.59 93.27 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 176.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 9.6 mp -54.85 -41.93 71.36 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.779 172.417 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.712 ' O ' ' HB ' ' A' ' 582' ' ' THR . 14.1 ttt180 -63.18 -31.71 72.92 Favored 'General case' 0 CA--C 1.56 1.344 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 174.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -66.16 -45.11 82.1 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 175.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -63.37 -22.06 66.65 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-O 121.833 0.825 . . . . 0.0 110.643 174.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.712 ' HB ' ' O ' ' A' ' 579' ' ' ARG . 16.3 m -67.8 -36.99 81.42 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 124.167 0.987 . . . . 0.0 111.124 176.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -56.68 -7.34 0.42 Allowed 'General case' 0 CA--C 1.57 1.732 0 C-N-CA 125.413 1.485 . . . . 0.0 113.66 -178.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 14.5 tt -72.25 -24.25 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 O-C-N 121.219 -0.925 . . . . 0.0 110.858 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 119.76 -56.5 0.59 Allowed Glycine 0 CA--C 1.524 0.621 0 N-CA-C 117.859 1.904 . . . . 0.0 117.859 169.312 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . 0.406 ' HA ' ' HG2' ' A' ' 588' ' ' GLU . 13.0 t70 -143.94 59.06 1.36 Allowed 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 119.712 1.756 . . . . 0.0 113.765 -172.163 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.445 HG13 ' HB2' ' A' ' 590' ' ' GLN . 2.4 t -94.36 17.59 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 164.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.406 ' HG2' ' HA ' ' A' ' 586' ' ' ASP . 10.1 mm-40 -33.31 -35.63 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 129.016 2.926 . . . . 0.0 118.804 -158.416 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 6.4 tt -68.73 -61.68 1.71 Allowed 'General case' 0 C--N 1.283 -2.319 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . 0.445 ' HB2' HG13 ' A' ' 587' ' ' VAL . 81.6 mm-40 -57.58 -44.38 85.28 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 113.803 -1.544 . . . . 0.0 109.419 176.479 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.505 ' O ' ' HG3' ' A' ' 595' ' ' GLN . 0.3 OUTLIER -60.06 -42.99 95.68 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 114.022 -1.445 . . . . 0.0 110.028 -175.483 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.482 ' HA ' ' NE2' ' A' ' 595' ' ' GLN . 85.5 t80 -53.7 -54.39 38.57 Favored 'General case' 0 CA--C 1.504 -0.818 0 O-C-N 124.271 0.982 . . . . 0.0 109.69 177.771 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . 0.548 ' O ' HG13 ' A' ' 597' ' ' ILE . 84.5 m-85 -62.92 -45.91 90.25 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.116 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . 0.477 ' O ' ' HB ' ' A' ' 597' ' ' ILE . 88.7 mt -60.9 -50.45 73.35 Favored 'General case' 0 C--O 1.252 1.188 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . 0.505 ' HG3' ' O ' ' A' ' 591' ' ' LYS 0.423 3.6 pp0? -70.93 -24.55 62.47 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 119.207 -0.997 . . . . 0.0 113.471 177.955 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -71.63 -25.34 62.11 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 119.351 -0.94 . . . . 0.0 111.048 171.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . 0.548 HG13 ' O ' ' A' ' 593' ' ' TYR . 74.6 mt -59.49 -51.6 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 171.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . 0.619 ' O ' ' HG2' ' A' ' 602' ' ' LYS . 12.4 p -65.06 -33.65 65.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.865 176.589 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . 0.431 ' HA ' ' HE3' ' A' ' 602' ' ' LYS . . . -58.02 -43.57 86.82 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.134 0.271 . . . . 0.0 110.572 177.205 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -63.14 -43.25 98.88 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.218 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . 0.619 ' O ' ' HB3' ' A' ' 604' ' ' ARG . 22.3 t-20 -66.47 -44.99 81.21 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.195 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.619 ' HG2' ' O ' ' A' ' 598' ' ' VAL . 33.4 pttt -71.86 -29.93 64.9 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 120.026 -0.669 . . . . 0.0 111.656 179.122 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -73.39 -17.73 61.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.222 0.534 . . . . 0.0 110.052 177.038 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . 0.619 ' HB3' ' O ' ' A' ' 601' ' ' ASN . 0.2 OUTLIER -65.53 -19.67 66.02 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.854 0.862 . . . . 0.0 110.221 175.34 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 C--O 1.255 1.365 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.087 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 . . . . . 0 C--O 1.237 0.407 0 CA-C-O 120.923 0.392 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -68.27 138.28 55.38 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.548 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -135.69 85.74 2.18 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 82.1 mt -61.62 111.76 1.96 Allowed 'General case' 0 C--N 1.291 -1.975 0 CA-C-O 121.572 0.701 . . . . 0.0 110.529 178.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.7 m -106.12 -170.71 1.77 Allowed 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.187 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 471' ' ' LYS . 39.0 ttm180 -58.22 -24.17 58.29 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.199 1.0 . . . . 0.0 111.24 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.56 ' O ' ' HG3' ' A' ' 473' ' ' GLU . 20.9 mp0 -60.11 -24.84 64.98 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.813 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.419 ' O ' ' HB2' ' A' ' 474' ' ' ARG . 8.3 tm-20 -66.48 -34.71 78.55 Favored 'General case' 0 C--O 1.206 -1.227 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 468' ' ' ARG . 13.3 tmtt? -66.36 -39.64 89.28 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.327 176.659 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -63.37 -49.3 74.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.839 178.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . 0.56 ' HG3' ' O ' ' A' ' 469' ' ' GLN . 36.6 mt-10 -67.71 -34.55 77.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.853 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.419 ' HB2' ' O ' ' A' ' 470' ' ' GLU . 37.2 ttp180 -61.08 -45.55 94.26 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 123.987 0.915 . . . . 0.0 109.681 175.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . 0.41 ' HA ' HD21 ' A' ' 542' ' ' LEU . . . -68.3 -41.83 80.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.74 -179.643 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -60.03 -51.06 71.25 Favored 'General case' 0 C--O 1.24 0.589 0 O-C-N 123.677 0.611 . . . . 0.0 110.27 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . 0.464 HD21 HG13 ' A' ' 507' ' ' VAL . 1.6 tt -57.8 -38.91 76.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.623 -1.171 . . . . 0.0 111.861 178.366 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 23.7 tptp -82.39 -13.94 56.01 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.714 -175.216 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -85.79 -53.86 4.87 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.325 -172.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.502 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 96.0 mt -101.71 107.69 18.99 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 121.766 0.793 . . . . 0.0 112.719 -173.103 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 53.1 mtt -94.74 -44.0 7.99 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.766 -174.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . 0.457 ' HG2' ' OE1' ' A' ' 520' ' ' GLN . 99.2 mtt180 -70.03 -31.14 68.64 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 122.378 1.085 . . . . 0.0 110.848 -179.443 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.502 ' HB2' ' HB3' ' A' ' 480' ' ' LEU . 4.7 m-20 -70.63 61.01 0.23 Allowed 'General case' 0 C--N 1.252 -3.653 0 C-N-CA 127.496 2.318 . . . . 0.0 116.83 -170.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . 0.571 ' HD3' ' OD2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -39.66 -41.51 1.07 Allowed 'General case' 0 N--CA 1.52 3.06 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 172.329 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -52.21 -52.93 49.32 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.053 0.941 . . . . 0.0 110.77 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.49 ' O ' ' HB3' ' A' ' 490' ' ' TYR . 68.0 m -64.14 -35.79 81.93 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.514 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -51.21 -54.07 29.13 Favored 'General case' 0 C--N 1.349 0.578 0 O-C-N 123.12 0.263 . . . . 0.0 110.634 177.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -78.54 -33.23 48.02 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 119.237 -0.985 . . . . 0.0 112.064 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.37 -32.83 74.02 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.176 0.512 . . . . 0.0 110.743 -176.185 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . 0.491 ' CE2' HG21 ' A' ' 494' ' ' VAL . 0.0 OUTLIER -86.59 -45.44 11.04 Favored 'General case' 0 N--CA 1.389 -3.513 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.954 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -56.12 -39.38 72.14 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -70.52 -25.15 62.99 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.505 0.669 . . . . 0.0 110.079 -176.621 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 23.1 m -90.01 -16.59 29.5 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 123.548 0.739 . . . . 0.0 112.641 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . 0.491 HG21 ' CE2' ' A' ' 490' ' ' TYR . 79.5 t -117.95 144.7 25.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -166.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . 0.479 ' OD2' ' HA ' ' A' ' 500' ' ' THR . 12.7 t70 71.49 -36.75 0.37 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 117.017 2.228 . . . . 0.0 117.017 167.557 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -41.8 -67.52 0.25 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -166.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . 0.264 8.6 m-20 -80.92 -73.22 0.38 Allowed 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 -175.419 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -101.41 -37.05 8.62 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -172.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -76.25 11.14 1.63 Allowed 'General case' 0 CA--C 1.56 1.351 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -173.512 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' THR . . . . . 0.479 ' HA ' ' OD2' ' A' ' 495' ' ' ASP . 25.7 m -53.68 105.74 0.15 Allowed 'General case' 0 C--O 1.249 1.059 0 C-N-CA 124.35 1.06 . . . . 0.0 113.639 -173.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -124.4 125.01 43.57 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 177.606 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -59.86 -9.04 2.53 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -171.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 8.8 t-80 -58.97 -49.54 77.49 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 172.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -63.95 -38.16 90.06 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.863 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -63.44 -50.24 70.53 Favored 'General case' 0 CA--C 1.501 -0.914 0 O-C-N 123.612 0.57 . . . . 0.0 109.63 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.434 ' O ' HG21 ' A' ' 510' ' ' VAL . 14.7 m-85 -56.61 -46.01 81.14 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.367 -178.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . 0.519 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 21.6 t -73.84 -46.37 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.541 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.844 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -51.72 -43.04 62.69 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 117.956 0.344 . . . . 0.0 111.647 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -57.09 -50.18 73.58 Favored 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 123.922 0.764 . . . . 0.0 109.135 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.434 HG21 ' O ' ' A' ' 506' ' ' TYR . 48.6 t -61.1 -51.12 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.666 175.844 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.519 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 95.5 mt -53.04 -51.03 63.06 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.763 -175.301 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -71.36 -32.7 68.81 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.977 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -66.74 -49.91 64.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.888 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . 0.282 1.0 OUTLIER -71.3 -26.53 62.9 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.28 177.312 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . 0.542 ' HA ' ' HB3' ' A' ' 519' ' ' ASP . 23.4 t80 -52.16 -41.17 62.37 Favored 'General case' 0 C--N 1.347 0.475 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 175.831 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -72.19 -15.06 61.95 Favored 'General case' 0 CA--C 1.555 1.153 0 CA-C-N 114.189 -1.368 . . . . 0.0 114.015 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -120.92 -57.25 1.89 Allowed 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -172.377 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -153.48 105.28 2.82 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 103.901 -2.629 . . . . 0.0 103.901 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . 0.571 ' OD2' ' HD3' ' A' ' 484' ' ' LYS . 8.0 p-10 -106.01 91.35 3.7 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 117.341 2.349 . . . . 0.0 117.341 -165.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . 0.457 ' OE1' ' HG2' ' A' ' 482' ' ' ARG . 25.2 mt-30 -145.06 158.45 43.81 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 126.707 2.003 . . . . 0.0 106.389 158.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -80.52 124.49 28.99 Favored 'General case' 0 N--CA 1.424 -1.747 0 CA-C-N 119.958 1.253 . . . . 0.0 108.668 176.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -107.68 148.31 29.55 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 42.2 pt -83.14 -14.98 11.75 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 122.951 0.5 . . . . 0.0 111.233 -175.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.607 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 42.4 p -57.16 -41.42 79.18 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.415 0.626 . . . . 0.0 109.501 176.32 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . 0.42 ' CG ' HG12 ' A' ' 510' ' ' VAL . 24.5 t70 -58.26 -49.62 76.47 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.17 177.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -59.83 -49.01 79.38 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.256 -178.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.616 ' O ' HG13 ' A' ' 530' ' ' VAL . 7.8 p -65.99 -29.29 46.37 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . 0.607 ' HG3' ' O ' ' A' ' 524' ' ' SER . 94.2 mt-30 -67.57 -43.5 80.44 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.751 0.786 . . . . 0.0 109.089 175.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 27.4 m-85 -78.59 4.51 13.29 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.616 HG13 ' O ' ' A' ' 527' ' ' VAL . 8.8 p -83.02 -2.4 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.977 -176.424 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -105.06 -15.23 15.15 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.415 1.103 . . . . 0.0 108.544 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 532' ' ' SER . . . . . 0.479 ' C ' ' H ' ' A' ' 534' ' ' GLU . 37.0 t -95.99 -143.16 0.27 Allowed 'General case' 0 C--N 1.296 -1.754 0 C-N-CA 127.574 2.35 . . . . 0.0 108.821 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . 0.537 ' C ' ' H ' ' A' ' 535' ' ' LEU . 7.8 p30 -29.97 30.05 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.363 1 C-N-CA 137.252 6.221 . . . . 0.0 116.916 171.515 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . 0.479 ' H ' ' C ' ' A' ' 532' ' ' SER . 10.0 pt-20 -30.83 10.67 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.708 1 C-N-CA 133.034 4.534 . . . . 0.0 117.962 -173.963 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.537 ' H ' ' C ' ' A' ' 533' ' ' ASN . 4.3 mp -69.41 -23.92 63.78 Favored 'General case' 0 C--N 1.278 -2.514 0 N-CA-C 102.566 -3.124 . . . . 0.0 102.566 160.346 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . 0.452 ' O ' HG12 ' A' ' 540' ' ' ILE . 5.6 tpp180 -68.24 -29.44 68.25 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 112.214 -2.266 . . . . 0.0 110.274 171.806 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 2.2 tm-20 -71.77 -40.14 69.49 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 -178.707 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.433 ' O ' ' HB2' ' A' ' 541' ' ' SER . 24.4 m -58.69 -43.4 89.96 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 170.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 22.6 tp -59.72 -36.5 76.68 Favored 'General case' 0 CA--C 1.56 1.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.762 177.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . 0.452 HG12 ' O ' ' A' ' 536' ' ' ARG . 35.3 mm -64.03 -37.96 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.506 0.722 . . . . 0.0 109.974 176.085 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' SER . . . . . 0.433 ' HB2' ' O ' ' A' ' 538' ' ' THR . 21.5 m -56.81 -39.11 73.55 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 121.122 0.487 . . . . 0.0 110.22 174.17 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.41 HD21 ' HA ' ' A' ' 475' ' ' ALA . 9.5 mp -66.51 -30.31 70.6 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.408 175.046 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -65.04 -45.13 86.7 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 175.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -75.59 45.99 0.34 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.195 174.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -50.86 136.57 22.22 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 125.024 1.33 . . . . 0.0 110.084 -177.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . 0.467 ' C ' ' H ' ' A' ' 548' ' ' ASN . 12.2 t30 -83.75 179.67 7.53 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.942 -172.335 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . 0.506 ' C ' ' H ' ' A' ' 549' ' ' ASP . 3.1 mm? -70.01 23.63 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.317 1.847 . . . . 0.0 113.851 -174.144 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . 0.467 ' H ' ' C ' ' A' ' 546' ' ' ASN . 17.4 m120 -75.45 24.75 0.11 Allowed 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 127.095 2.158 . . . . 0.0 110.208 174.563 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . 0.506 ' H ' ' C ' ' A' ' 547' ' ' LEU . 11.0 m-20 -58.88 32.72 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 127.97 2.508 . . . . 0.0 117.493 -172.276 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -74.68 160.05 81.86 Favored Pre-proline 0 C--N 1.3 -1.563 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -37.4 130.36 0.66 Allowed 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 123.562 2.841 . . . . 0.0 111.233 178.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 31.3 p90 -73.37 -6.98 49.68 Favored 'General case' 0 CA--C 1.495 -1.155 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -167.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 59.0 mp0 -71.36 -1.08 11.73 Favored 'General case' 0 C--N 1.291 -1.944 0 C-N-CA 124.256 1.023 . . . . 0.0 111.527 174.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -62.73 -21.57 65.9 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 123.827 0.851 . . . . 0.0 108.887 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -48.27 -62.96 1.22 Allowed 'General case' 0 C--O 1.215 -0.763 0 C-N-CA 124.58 1.152 . . . . 0.0 113.93 -177.207 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 16.8 mt -66.39 -36.78 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-O 120.87 0.367 . . . . 0.0 110.14 -174.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . 0.461 ' HA ' ' NH2' ' A' ' 579' ' ' ARG . 9.9 t70 -56.98 -52.02 66.89 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.787 177.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . 0.447 ' O ' HG22 ' A' ' 562' ' ' VAL . 32.8 t70 -66.94 -49.97 63.82 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.278 178.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -49.75 -53.57 24.18 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.17 1.788 . . . . 0.0 111.655 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 65.4 t -63.21 -47.93 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.625 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -60.14 -41.61 93.07 Favored 'General case' 0 C--O 1.201 -1.458 0 O-C-N 123.069 0.231 . . . . 0.0 111.275 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . 0.447 HG22 ' O ' ' A' ' 558' ' ' ASP . 69.9 t -62.74 -37.3 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-O 121.403 0.62 . . . . 0.0 111.708 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.442 ' HA ' ' CG ' ' A' ' 469' ' ' GLN . 54.6 mt -87.24 -39.8 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.916 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.306 -173.505 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . 0.623 ' ND2' ' HA ' ' A' ' 572' ' ' GLU . 6.4 t30 -81.93 -14.98 55.34 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.01 -174.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -71.95 -13.06 61.53 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.47 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . 0.529 ' HB2' ' NE2' ' A' ' 469' ' ' GLN . 63.0 tttm -60.76 -23.02 64.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.612 176.246 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . 0.458 ' HA3' ' HB ' ' A' ' 571' ' ' ILE . . . -89.8 1.61 81.19 Favored Glycine 0 N--CA 1.433 -1.542 0 C-N-CA 120.826 -0.702 . . . . 0.0 113.037 -179.22 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . 0.414 ' HA ' ' OE1' ' A' ' 568' ' ' GLN . 9.5 mm-40 60.07 -167.22 0.18 Allowed 'General case' 0 C--O 1.249 1.069 0 C-N-CA 124.617 1.167 . . . . 0.0 112.278 176.339 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.41 69.61 1.65 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 122.914 1.34 . . . . 0.0 112.862 -177.606 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 16.9 m -159.16 -62.69 0.08 Allowed 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 105.333 -2.099 . . . . 0.0 105.333 175.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . 0.458 ' HB ' ' HA3' ' A' ' 567' ' ' GLY . 55.5 mt -77.27 -40.18 29.17 Favored 'Isoleucine or valine' 0 CA--C 1.474 -1.972 0 CA-C-N 114.51 -1.223 . . . . 0.0 109.374 178.684 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . 0.623 ' HA ' ' ND2' ' A' ' 564' ' ' ASN . 18.4 tp10 -73.01 -24.62 60.77 Favored 'General case' 0 N--CA 1.392 -3.371 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.245 -176.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 573' ' ' SER . . . . . 0.535 ' O ' ' HG3' ' A' ' 602' ' ' LYS . 15.0 m -62.91 -44.96 94.68 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.511 175.549 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 67.5 mt -54.03 -43.68 70.35 Favored 'General case' 0 C--O 1.21 -1.014 0 C-N-CA 123.878 0.871 . . . . 0.0 108.878 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . 0.479 ' HB3' ' O ' ' A' ' 572' ' ' GLU . 65.0 t30 -59.07 -38.6 79.83 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 125.759 1.624 . . . . 0.0 112.646 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -59.93 -43.88 94.69 Favored 'General case' 0 C--O 1.255 1.392 0 CA-C-O 122.321 1.057 . . . . 0.0 108.342 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 80.7 tttt -74.11 -35.09 64.14 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.909 176.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.45 ' HB3' ' O ' ' A' ' 575' ' ' ASN . 39.9 tp -52.04 -42.14 62.86 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 123.772 0.829 . . . . 0.0 110.234 171.789 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.504 ' HG3' ' OE1' ' A' ' 595' ' ' GLN . 16.9 tpp180 -59.85 -41.48 91.52 Favored 'General case' 0 C--O 1.263 1.787 0 CA-C-O 121.705 0.764 . . . . 0.0 109.251 175.62 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . 0.417 ' HA ' ' NE2' ' A' ' 595' ' ' GLN . 38.2 tt0 -60.81 -38.92 87.04 Favored 'General case' 0 C--O 1.198 -1.607 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.846 173.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -63.79 -29.3 70.51 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 121.323 0.583 . . . . 0.0 111.496 173.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.406 ' C ' ' H ' ' A' ' 584' ' ' ILE . 13.5 m -65.89 -24.3 66.82 Favored 'General case' 0 C--O 1.209 -1.044 0 C-N-CA 125.625 1.57 . . . . 0.0 111.787 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.646 ' HA ' ' CD ' ' A' ' 588' ' ' GLU . 30.9 ptt-85 -33.97 16.73 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.934 0 N-CA-C 118.994 2.961 . . . . 0.0 118.994 174.988 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . 0.406 ' H ' ' C ' ' A' ' 582' ' ' THR . 34.4 pt -80.0 -11.49 12.85 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 O-C-N 120.767 -1.208 . . . . 0.0 110.092 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 126.71 37.9 0.46 Allowed Glycine 0 N--CA 1.479 1.558 0 C-N-CA 118.758 -1.687 . . . . 0.0 114.286 173.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . 0.524 ' C ' ' H ' ' A' ' 588' ' ' GLU . 27.2 t70 -99.58 169.35 9.35 Favored 'General case' 0 C--N 1.263 -3.164 0 C-N-CA 126.264 1.825 . . . . 0.0 108.268 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.585 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 35.6 m -50.44 -1.44 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 CA-C-N 119.924 1.238 . . . . 0.0 111.085 168.035 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.646 ' CD ' ' HA ' ' A' ' 583' ' ' ARG . 0.0 OUTLIER -55.56 -17.04 4.67 Favored 'General case' 0 C--O 1.155 -3.881 0 C-N-CA 125.955 1.702 . . . . 0.0 110.956 167.795 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . 0.525 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 9.2 mp -66.76 -43.23 84.64 Favored 'General case' 0 C--O 1.286 2.992 0 CA-C-O 122.629 1.204 . . . . 0.0 109.373 170.357 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . 0.585 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 58.2 tp60 -56.28 -40.37 74.16 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 113.775 -1.557 . . . . 0.0 107.944 174.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.401 ' O ' ' HB3' ' A' ' 594' ' ' LEU . 40.2 mmtm -84.29 -13.01 53.65 Favored 'General case' 0 C--O 1.189 -2.118 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.408 174.74 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.525 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 43.0 t80 -60.15 -40.94 91.6 Favored 'General case' 0 CA--C 1.456 -2.653 0 C-N-CA 124.047 0.939 . . . . 0.0 109.682 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -54.8 -46.4 74.48 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.274 173.467 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . 0.551 ' O ' HG22 ' A' ' 598' ' ' VAL . 1.5 tt -61.16 -55.1 36.26 Favored 'General case' 0 C--O 1.207 -1.139 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.195 176.418 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . 0.504 ' OE1' ' HG3' ' A' ' 579' ' ' ARG . 6.2 pt20 -64.87 -30.11 71.09 Favored 'General case' 0 C--O 1.197 -1.704 0 C-N-CA 124.285 1.034 . . . . 0.0 111.639 -171.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . 0.485 ' O ' ' HG3' ' A' ' 600' ' ' LYS . 8.1 tt0 -63.06 -59.68 4.47 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 106.666 -1.605 . . . . 0.0 106.666 176.767 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 75.2 mt -56.94 -62.72 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 CA-C-N 113.868 -1.515 . . . . 0.0 111.51 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . 0.551 HG22 ' O ' ' A' ' 594' ' ' LEU . 18.6 m -70.21 -35.71 64.41 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.551 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -172.932 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -67.83 -31.85 71.98 Favored 'General case' 0 CA--C 1.488 -1.416 0 CA-C-N 120.018 1.281 . . . . 0.0 110.706 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . 0.575 ' O ' ' HG3' ' A' ' 604' ' ' ARG . 98.9 mttt -60.98 -49.38 77.68 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 119.435 -0.906 . . . . 0.0 108.687 173.408 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -64.96 -32.54 74.31 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.848 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.535 ' HG3' ' O ' ' A' ' 573' ' ' SER . 0.4 OUTLIER -71.93 -43.49 65.21 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . 0.452 ' C ' ' H ' ' A' ' 605' ' ' MET . 10.8 mm-40 -73.22 -15.49 61.43 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.669 179.293 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . 0.575 ' HG3' ' O ' ' A' ' 600' ' ' LYS . 95.9 mtt180 -73.18 36.91 0.08 Allowed 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.811 0.844 . . . . 0.0 111.673 175.598 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 605' ' ' MET . . . . . 0.452 ' H ' ' C ' ' A' ' 603' ' ' GLU . 23.4 ptt? . . . . . 0 C--N 1.306 -1.296 0 C-N-CA 124.092 0.957 . . . . 0.0 109.235 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 . . . . . 0 N--CA 1.441 -0.875 0 CA-C-O 121.639 0.733 . . . . 0.0 112.618 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -76.27 96.92 4.05 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 174.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.11 46.87 2.38 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-O 122.78 1.276 . . . . 0.0 108.932 179.448 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -71.57 134.75 46.66 Favored 'General case' 0 N--CA 1.412 -2.327 0 CA-C-N 113.683 -1.599 . . . . 0.0 108.657 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.8 m -57.04 107.37 0.4 Allowed 'General case' 0 C--N 1.289 -2.036 0 O-C-N 124.278 0.986 . . . . 0.0 113.012 -174.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 4.9 ptm85 -65.2 -22.89 66.95 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 177.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.669 ' NE2' ' HB3' ' A' ' 566' ' ' LYS . 97.4 mt-30 -66.3 -32.15 73.38 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 174.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.633 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 3.2 tm-20 -71.24 -28.47 64.2 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 12.8 tmtt? -66.69 -35.42 80.1 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.513 176.286 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.47 99.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.157 0.504 . . . . 0.0 109.72 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . 0.485 ' CD ' ' HZ1' ' A' ' 496' ' ' LYS . 34.6 mt-10 -66.35 -35.6 80.75 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.92 177.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.633 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 90.8 mtt180 -57.24 -43.29 82.78 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 175.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . 0.471 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -66.19 -48.36 70.93 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.477 178.026 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.94 -8.31 6.91 Favored 'General case' 0 C--O 1.25 1.129 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 178.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . 0.687 ' O ' ' HG ' ' A' ' 480' ' ' LEU . 1.0 OUTLIER -55.83 -27.87 53.52 Favored 'General case' 0 C--O 1.21 -1.025 0 O-C-N 122.053 -0.404 . . . . 0.0 111.314 174.824 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.471 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 47.8 pttt -56.83 -7.96 0.53 Allowed 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 124.486 1.114 . . . . 0.0 112.495 176.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . 0.552 ' CD2' ' HA ' ' A' ' 487' ' ' PHE . 24.1 p-80 -52.95 -31.24 39.38 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.312 1.045 . . . . 0.0 110.335 177.319 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.687 ' HG ' ' O ' ' A' ' 477' ' ' LEU . 1.9 pp -71.99 5.75 2.5 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.524 1.129 . . . . 0.0 113.221 -173.134 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 92.8 mmm -94.38 -27.57 15.99 Favored 'General case' 0 N--CA 1.42 -1.954 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.014 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . 0.58 ' HB3' ' OG1' ' A' ' 486' ' ' THR . 40.0 ttt180 -78.18 -98.57 0.02 OUTLIER 'General case' 0 C--N 1.367 1.338 0 C-N-CA 117.79 -1.564 . . . . 0.0 109.71 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -145.35 -94.65 0.1 Allowed 'General case' 0 C--N 1.385 2.14 0 C-N-CA 113.462 -3.295 . . . . 0.0 117.752 161.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -101.2 -43.75 5.89 Favored 'General case' 0 CA--C 1.482 -1.664 0 CA-C-O 122.718 1.247 . . . . 0.0 112.183 174.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . 0.418 ' O ' ' HB2' ' A' ' 489' ' ' ASN . 5.8 p-10 -54.16 -43.19 70.41 Favored 'General case' 0 CA--C 1.483 -1.602 0 CA-C-N 112.507 -2.133 . . . . 0.0 109.911 -175.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.58 ' OG1' ' HB3' ' A' ' 482' ' ' ARG . 2.7 m -67.4 -35.34 79.1 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.336 -174.424 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . 0.552 ' HA ' ' CD2' ' A' ' 479' ' ' HIS . 49.1 t80 -62.59 -55.67 25.02 Favored 'General case' 0 CA--C 1.496 -1.113 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.897 178.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 2.0 tp -75.63 -22.98 56.34 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.809 -176.783 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . 0.418 ' HB2' ' O ' ' A' ' 485' ' ' ASP . 5.4 t30 -63.23 -47.01 84.27 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -176.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.33 -32.8 24.1 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.163 -1.015 . . . . 0.0 111.53 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -69.93 -38.02 76.09 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 123.408 0.683 . . . . 0.0 112.16 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -79.93 -30.16 39.88 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 120.906 0.384 . . . . 0.0 110.981 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 36.5 m -77.99 -40.41 39.23 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.577 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . 0.46 HG21 ' HH ' ' A' ' 559' ' ' TYR . 58.8 t -99.72 100.02 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 CA-C-O 121.859 0.838 . . . . 0.0 109.436 -177.473 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -87.09 21.06 2.45 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.556 -176.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.485 ' HZ1' ' CD ' ' A' ' 473' ' ' GLU . 1.5 ttpm? -90.13 18.02 6.36 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -64.03 -20.44 65.92 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 124.79 1.236 . . . . 0.0 113.953 -171.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -82.33 -21.49 35.99 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.32 0.581 . . . . 0.0 110.492 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -79.79 -25.45 40.91 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.08 -179.134 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 3.3 m -67.3 140.03 57.29 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.91 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.03 175.75 2.99 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 124.841 1.256 . . . . 0.0 112.54 -176.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . 0.457 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -57.42 -19.69 25.22 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.626 1.17 . . . . 0.0 112.261 -178.211 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . 0.449 ' O ' HG22 ' A' ' 507' ' ' VAL . 17.1 t-160 -55.97 -40.01 72.64 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 125.146 1.378 . . . . 0.0 109.228 177.889 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . 0.561 ' O ' ' HD1' ' A' ' 508' ' ' PHE . 55.3 t80 -57.74 -53.16 61.31 Favored 'General case' 0 C--O 1.203 -1.365 0 C-N-CA 125.572 1.549 . . . . 0.0 108.619 177.247 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.457 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 72.5 tttt -57.93 -43.3 86.18 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 125.771 1.629 . . . . 0.0 111.923 -173.488 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -61.49 -56.11 23.72 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.49 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . 0.564 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 3.2 t -67.48 -46.99 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.705 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.808 -174.764 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . 0.561 ' HD1' ' O ' ' A' ' 504' ' ' PHE . 59.2 m-85 -55.3 -34.6 64.29 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 178.181 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -60.76 -52.43 65.14 Favored 'General case' 0 C--O 1.256 1.41 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 176.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 17.9 t -63.29 -46.26 96.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.898 177.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 93.5 mt -59.76 -49.28 78.34 Favored 'General case' 0 C--O 1.206 -1.198 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.545 -176.317 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -66.36 -28.7 68.85 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.737 0.303 . . . . 0.0 110.352 -177.394 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -70.44 -27.75 64.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.194 0.521 . . . . 0.0 110.249 177.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -83.07 -42.42 17.46 Favored 'General case' 0 CA--C 1.481 -1.677 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 175.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -50.24 -24.91 3.17 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.663 1.185 . . . . 0.0 111.349 176.779 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -52.71 -35.63 56.01 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 173.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -108.81 -61.32 1.63 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 119.62 -0.832 . . . . 0.0 109.482 173.744 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -159.14 135.71 9.3 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -75.84 97.01 3.8 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 120.47 1.486 . . . . 0.0 108.756 177.731 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -137.51 94.88 2.98 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.43 -176.424 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . 0.466 ' CG ' HD23 ' A' ' 480' ' ' LEU . 0.1 OUTLIER -58.45 143.63 44.82 Favored 'General case' 0 N--CA 1.401 -2.896 0 CA-C-O 121.604 0.716 . . . . 0.0 112.101 173.715 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -118.45 135.02 54.61 Favored 'General case' 0 C--N 1.285 -2.234 0 N-CA-C 105.14 -2.171 . . . . 0.0 105.14 173.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . 0.428 ' O ' HG11 ' A' ' 527' ' ' VAL . 3.9 tp -53.68 -34.47 24.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 O-C-N 123.659 0.599 . . . . 0.0 112.032 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 28.9 t -55.36 -48.86 73.61 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 122.977 0.511 . . . . 0.0 111.01 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.04 -42.85 99.61 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.89 0.852 . . . . 0.0 110.255 178.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . 0.418 ' HB2' ' CE2' ' A' ' 521' ' ' TYR . . . -58.74 -52.99 63.33 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.788 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.428 HG11 ' O ' ' A' ' 523' ' ' ILE . 14.1 p -70.36 -36.23 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.924 0 C-N-CA 123.366 0.666 . . . . 0.0 111.998 -177.993 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -71.67 -12.95 61.59 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 121.074 -1.016 . . . . 0.0 110.651 177.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.495 ' HB3' ' HG3' ' A' ' 536' ' ' ARG . 0.0 OUTLIER -76.52 -3.91 39.89 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.991 173.229 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . . . . . . . . . 4.7 p -72.88 22.57 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.573 1.83 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -176.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -70.41 -34.96 73.12 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 121.186 -0.946 . . . . 0.0 108.635 174.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 23.1 t -91.42 111.04 22.37 Favored 'General case' 0 N--CA 1.42 -1.939 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 170.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -61.4 -60.98 2.88 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.098 -174.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -56.31 -46.58 79.78 Favored 'General case' 0 C--O 1.244 0.794 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.62 -174.811 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.59 -56.5 9.18 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.002 -173.069 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . 0.495 ' HG3' ' HB3' ' A' ' 529' ' ' TYR . 2.3 mmt180 -72.4 -28.24 62.86 Favored 'General case' 0 N--CA 1.419 -2.018 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.45 -52.44 65.36 Favored 'General case' 0 C--O 1.251 1.174 0 CA-C-N 119.261 0.937 . . . . 0.0 110.002 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.432 ' O ' ' HB2' ' A' ' 541' ' ' SER . 1.9 p -63.93 -46.08 86.36 Favored 'General case' 0 N--CA 1.425 -1.689 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.284 177.55 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 19.0 tp -62.82 -32.89 74.18 Favored 'General case' 0 CA--C 1.56 1.341 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . 0.435 HG13 ' O ' ' A' ' 536' ' ' ARG . 55.9 mt -66.94 -38.42 81.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 173.218 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 538' ' ' THR . 50.0 m -57.28 -38.54 74.08 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.047 172.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.606 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 3.9 mm? -71.78 -27.3 62.85 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 173.352 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -61.83 -56.09 23.11 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 174.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . 0.424 ' HG2' ' O ' ' A' ' 540' ' ' ILE . 28.1 pt20 -80.21 13.25 2.42 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.665 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . 0.606 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 2.9 t80 -66.26 118.33 9.81 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.655 0.741 . . . . 0.0 110.93 177.524 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -94.03 120.62 34.54 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.714 -175.382 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -83.15 7.15 16.89 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -177.228 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -81.93 -21.13 37.46 Favored 'General case' 0 C--N 1.312 -1.049 0 O-C-N 121.304 -0.873 . . . . 0.0 109.799 175.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -69.31 -67.55 0.47 Allowed 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -86.5 111.65 40.9 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 167.485 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -50.1 146.61 17.13 Favored 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 123.464 2.776 . . . . 0.0 114.579 -170.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -73.97 -2.92 26.12 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 122.145 0.974 . . . . 0.0 111.043 -173.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -81.97 -41.59 20.56 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.518 170.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -73.07 -22.05 60.67 Favored 'General case' 0 C--O 1.185 -2.316 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -24.71 -70.3 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 126.629 1.972 . . . . 0.0 113.428 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 53.2 mt -68.46 -47.88 75.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.82 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -59.29 -48.89 79.92 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.097 -0.956 . . . . 0.0 113.026 -175.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -66.46 -51.39 57.31 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 124.084 0.953 . . . . 0.0 110.638 -177.549 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.46 ' HH ' HG21 ' A' ' 494' ' ' VAL . 40.6 t80 -51.58 -52.13 49.88 Favored 'General case' 0 C--O 1.246 0.872 0 C-N-CA 124.157 0.983 . . . . 0.0 110.474 176.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 95.0 t -66.91 -40.16 85.12 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.738 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -58.73 -39.4 80.77 Favored 'General case' 0 C--O 1.196 -1.757 0 C-N-CA 122.993 0.517 . . . . 0.0 110.637 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . 0.419 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 47.2 t -66.32 -36.59 77.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.418 0.628 . . . . 0.0 111.873 177.169 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.497 ' HA ' ' HG2' ' A' ' 469' ' ' GLN . 49.6 mt -78.67 -43.93 25.68 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 CA-C-O 121.738 0.78 . . . . 0.0 109.678 -177.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -77.94 -6.55 54.75 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.152 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.419 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 29.2 tt0 -61.74 -45.58 93.31 Favored 'General case' 0 CA--C 1.49 -1.346 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 175.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . 0.669 ' HB3' ' NE2' ' A' ' 469' ' ' GLN . 59.4 tttm -89.94 53.25 2.48 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 122.554 1.168 . . . . 0.0 108.129 178.207 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . 0.464 ' O ' HD11 ' A' ' 571' ' ' ILE . . . -102.7 -108.61 3.25 Favored Glycine 0 N--CA 1.419 -2.465 0 CA-C-N 113.941 -1.481 . . . . 0.0 110.619 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . 0.442 ' HA ' ' SD ' ' A' ' 605' ' ' MET . 8.7 tt0 78.29 170.42 0.2 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.459 1.103 . . . . 0.0 109.324 -174.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -42.43 129.72 3.92 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.921 1.289 . . . . 0.0 111.867 -174.261 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 38.1 m 87.76 -35.64 0.03 OUTLIER 'General case' 0 C--N 1.349 0.579 0 C-N-CA 126.766 2.026 . . . . 0.0 111.148 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . 0.464 HD11 ' O ' ' A' ' 567' ' ' GLY . 4.5 mt -89.78 -22.93 6.29 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.302 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -176.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.4 -1.4 0.76 Allowed 'General case' 0 N--CA 1.418 -2.068 0 C-N-CA 125.826 1.65 . . . . 0.0 113.202 176.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 36.9 t -64.92 -20.82 66.65 Favored 'General case' 0 N--CA 1.418 -2.04 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 168.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 97.8 mt -61.21 -21.48 63.88 Favored 'General case' 0 C--O 1.199 -1.579 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.011 170.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . 0.487 ' O ' ' HB3' ' A' ' 578' ' ' LEU . 0.9 OUTLIER -59.09 -40.75 86.26 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 172.415 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 -62.78 -50.24 71.81 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -26.65 68.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.294 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.512 ' CD2' ' HZ3' ' A' ' 591' ' ' LYS . 0.8 OUTLIER -57.57 -44.22 85.14 Favored 'General case' 0 C--O 1.256 1.439 0 C-N-CA 123.903 0.881 . . . . 0.0 109.898 172.362 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.438 ' HA ' ' CD ' ' A' ' 591' ' ' LYS . 40.5 ttp180 -63.87 -43.01 97.35 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.014 174.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.91 -52.41 57.81 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 123.656 0.598 . . . . 0.0 111.579 175.15 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -57.47 -38.29 74.29 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.491 ' C ' ' H ' ' A' ' 584' ' ' ILE . 3.6 m -71.38 -23.63 61.92 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 177.067 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.435 ' C ' ' H ' ' A' ' 585' ' ' GLY . 82.1 mtp180 -51.44 -1.21 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 173.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . 0.491 ' H ' ' C ' ' A' ' 582' ' ' THR . 13.9 tt -74.85 31.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.58 2.119 0 C-N-CA 125.667 1.587 . . . . 0.0 111.269 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . 0.435 ' H ' ' C ' ' A' ' 583' ' ' ARG . . . 130.58 -25.86 4.17 Favored Glycine 0 C--N 1.296 -1.667 0 N-CA-C 117.538 1.775 . . . . 0.0 117.538 168.097 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . 0.538 ' O ' ' HB2' ' A' ' 590' ' ' GLN . 23.2 t70 -138.11 89.22 2.38 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-N 120.331 2.066 . . . . 0.0 111.808 176.444 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.486 ' O ' ' HB3' ' A' ' 591' ' ' LYS . 35.2 m -71.55 -41.84 72.15 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 CA-C-N 114.41 -1.268 . . . . 0.0 112.912 178.076 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -67.02 -70.88 0.22 Allowed 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -168.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 36.5 tp -76.03 -50.48 14.67 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.839 -172.474 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . 0.538 ' HB2' ' O ' ' A' ' 586' ' ' ASP . 32.3 mm-40 -55.47 -50.31 70.21 Favored 'General case' 0 CA--C 1.494 -1.178 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.475 178.585 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.537 ' HE3' ' HA ' ' A' ' 591' ' ' LYS 0.269 1.6 tpmt? -81.2 -32.89 33.29 Favored 'General case' 0 N--CA 1.4 -2.926 0 C-N-CA 117.572 -1.651 . . . . 0.0 113.449 -173.297 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -53.79 -52.03 61.56 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.103 0.865 . . . . 0.0 110.075 177.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . 0.454 ' O ' HG13 ' A' ' 597' ' ' ILE . 56.4 t80 -59.74 -59.13 5.92 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.359 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 7.3 mp -59.65 -45.64 91.4 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -177.461 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . 0.422 ' HA ' HG11 ' A' ' 598' ' ' VAL . 0.0 OUTLIER -69.69 -34.75 74.38 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 122.193 -0.317 . . . . 0.0 111.547 -175.18 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -63.53 -44.39 94.35 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 593' ' ' TYR . 77.3 mt -55.03 -56.78 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.114 177.374 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . 0.422 HG11 ' HA ' ' A' ' 595' ' ' GLN . 7.3 p -67.06 -36.09 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -62.69 -44.51 96.06 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-O 121.928 0.871 . . . . 0.0 110.15 178.553 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -69.59 -33.76 73.16 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.608 177.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -66.49 -38.41 87.21 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.263 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -69.75 -39.39 76.76 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.911 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.86 -25.33 62.77 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 119.514 -0.874 . . . . 0.0 110.323 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -68.56 -26.19 65.28 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.681 175.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 605' ' ' MET . . . . . 0.442 ' SD ' ' HA ' ' A' ' 568' ' ' GLN . 43.9 ttm . . . . . 0 C--O 1.245 0.855 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 -178.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 37.8 p90 . . . . . 0 N--CA 1.434 -1.229 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -91.0 107.15 19.01 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.567 174.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -124.02 46.54 2.24 Favored 'General case' 0 C--N 1.288 -2.072 0 C-N-CA 119.246 -0.982 . . . . 0.0 109.057 178.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 98.9 mt -75.97 89.01 2.95 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 168.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 17.0 m -58.9 136.72 57.95 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 114.021 -1.445 . . . . 0.0 114.298 -171.113 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -65.83 -32.78 74.5 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.911 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.456 ' HG2' ' HA ' ' A' ' 563' ' ' ILE . 97.3 mt-30 -64.28 -41.85 96.69 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 175.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.503 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 5.8 tm-20 -63.34 -29.05 70.42 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.287 178.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 25.9 mmtm -66.34 -37.86 86.32 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.555 171.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.44 -36.96 71.44 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.118 -177.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . 0.434 ' HB3' ' CZ ' ' A' ' 504' ' ' PHE . 0.9 OUTLIER -57.94 -40.81 81.4 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 123.327 0.392 . . . . 0.0 110.777 171.863 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.503 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 93.4 mtt180 -62.37 -42.81 99.7 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 177.285 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -67.44 -29.88 69.47 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.058 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -66.03 -33.58 76.12 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.68 0.752 . . . . 0.0 109.875 177.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 87.3 mt -76.52 10.57 2.03 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.446 177.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.433 ' HE3' ' CD2' ' A' ' 545' ' ' TYR . 18.9 tptm -59.88 -10.62 4.18 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.433 1.093 . . . . 0.0 112.989 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -74.76 142.03 44.35 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.908 -0.495 . . . . 0.0 111.424 -176.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.527 ' H ' HD12 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -75.66 -150.77 0.03 OUTLIER 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.792 175.252 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' MET . . . . . 0.469 ' C ' ' H ' ' A' ' 483' ' ' ASP . 66.8 mtt -50.4 -9.88 0.05 Allowed 'General case' 0 N--CA 1.516 2.851 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 -177.411 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -72.92 7.12 2.18 Favored 'General case' 0 CA--C 1.561 1.386 0 C-N-CA 125.185 1.394 . . . . 0.0 109.518 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.469 ' H ' ' C ' ' A' ' 481' ' ' MET . 5.5 p-10 -70.41 -10.96 60.52 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 125.701 1.6 . . . . 0.0 113.65 -170.178 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -63.02 -44.63 95.44 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.738 0.78 . . . . 0.0 109.649 176.086 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.61 -51.67 66.38 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 114.726 -1.124 . . . . 0.0 109.649 178.428 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 59.0 m -61.81 -40.64 95.95 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 114.561 -1.199 . . . . 0.0 111.995 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . 0.528 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 23.1 t80 -56.57 -53.28 59.4 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 122.394 0.278 . . . . 0.0 110.734 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . 0.436 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 65.8 mt -72.73 -25.46 61.22 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.588 -178.834 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -69.23 -39.85 78.28 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.636 0.731 . . . . 0.0 110.085 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.79 -21.48 26.47 Favored 'General case' 0 N--CA 1.424 -1.737 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.326 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . 0.528 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.3 OUTLIER -67.03 -41.24 86.94 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 123.801 0.84 . . . . 0.0 109.332 178.878 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 8.9 pt-20 -77.92 -46.32 21.6 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -176.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 27.5 p -89.98 -28.65 18.98 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -170.435 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 47.0 t -91.2 162.7 2.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 O-C-N 122.012 -0.43 . . . . 0.0 111.187 -170.297 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -75.09 109.82 8.88 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 121.896 0.855 . . . . 0.0 111.05 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -88.9 -25.02 22.34 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.143 -1.389 . . . . 0.0 108.715 176.752 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -86.75 -66.57 0.89 Allowed 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 118.845 2.906 . . . . 0.0 118.845 -166.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -107.27 -34.15 7.19 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 118.723 2.86 . . . . 0.0 118.723 -160.223 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -76.77 -94.97 0.02 OUTLIER 'General case' 0 CA--C 1.566 1.574 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -163.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 19.6 m -129.84 76.08 1.7 Allowed 'General case' 0 C--N 1.314 -0.977 0 O-C-N 120.794 -1.191 . . . . 0.0 109.303 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -130.79 45.87 2.75 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 117.397 2.369 . . . . 0.0 117.397 -170.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -84.85 -33.65 22.8 Favored 'General case' 0 CA--C 1.492 -1.278 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 170.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . 0.536 ' CD2' HD12 ' A' ' 535' ' ' LEU . 45.4 m170 -59.25 -51.68 68.94 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . 0.434 ' CZ ' ' HB3' ' A' ' 473' ' ' GLU . 97.0 m-85 -68.01 -25.76 65.55 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 113.973 -1.467 . . . . 0.0 114.308 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -63.83 -46.83 83.32 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 175.522 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.572 ' O ' HG22 ' A' ' 510' ' ' VAL . 2.6 t80 -64.37 -32.56 74.23 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.893 -1.049 . . . . 0.0 112.379 174.892 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.53 -50.4 72.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 173.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -51.98 -43.01 63.38 Favored 'General case' 0 C--N 1.355 0.845 0 CA-C-O 120.899 0.38 . . . . 0.0 110.126 173.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -55.98 -60.11 3.95 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.341 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 506' ' ' TYR . 21.5 t -58.07 -53.58 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 O-C-N 123.57 0.544 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.58 -36.94 85.25 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -174.007 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -70.06 -32.2 70.18 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.485 -0.486 . . . . 0.0 109.808 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -72.43 -27.69 62.49 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 178.22 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -67.04 -54.24 23.49 Favored 'General case' 0 CA--C 1.49 -1.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.907 171.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -49.96 -29.68 8.95 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.801 0.84 . . . . 0.0 112.552 178.333 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -63.77 -36.23 83.21 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.572 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -111.89 -59.41 1.99 Allowed 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.4 -176.116 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -157.31 118.81 3.69 Favored 'General case' 0 CA--C 1.493 -1.224 0 C-N-CA 125.148 1.379 . . . . 0.0 107.659 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -90.95 92.51 8.79 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -175.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -144.4 128.93 18.05 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 126.49 1.916 . . . . 0.0 107.055 162.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -70.32 132.42 45.65 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 119.546 1.066 . . . . 0.0 110.453 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -118.73 135.0 54.73 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 34.5 pt -79.47 -16.21 13.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 122.152 0.977 . . . . 0.0 110.216 -175.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 5.6 p -60.05 -30.9 69.5 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.258 172.318 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.73 -39.64 91.34 Favored 'General case' 0 CA--C 1.481 -1.675 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.771 178.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.3 99.59 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.325 -0.95 . . . . 0.0 109.34 175.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.507 ' O ' HG12 ' A' ' 530' ' ' VAL . 61.5 t -61.8 -35.92 70.65 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.375 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.966 175.416 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -72.24 -24.24 61.34 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 121.498 -0.751 . . . . 0.0 111.332 176.517 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 9.2 m-85 -79.64 -23.08 42.82 Favored 'General case' 0 N--CA 1.44 -0.97 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 175.788 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.507 HG12 ' O ' ' A' ' 527' ' ' VAL 0.369 12.2 p -75.93 55.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.241 0.606 0 CA-C-O 123.062 1.41 . . . . 0.0 114.034 -177.99 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -105.0 -29.95 10.1 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 104.209 -2.515 . . . . 0.0 104.209 172.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 46.5 m -92.92 161.9 14.29 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 164.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -86.29 -58.43 2.63 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 -176.143 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.17 -79.64 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 -161.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.536 HD12 ' CD2' ' A' ' 503' ' ' HIS . 2.6 mm? -75.44 -17.27 60.2 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 122.109 0.956 . . . . 0.0 112.132 -172.252 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -77.84 -46.0 22.72 Favored 'General case' 0 C--N 1.272 -2.799 0 CA-C-N 113.775 -1.557 . . . . 0.0 107.523 -173.604 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -66.5 -38.32 86.98 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.086 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 32.1 m -57.07 -51.61 68.6 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.709 178.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 27.9 tp -57.7 -45.55 85.52 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 111.323 0.12 . . . . 0.0 111.323 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 78.9 mt -60.18 -37.79 74.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-O 121.424 0.631 . . . . 0.0 110.289 176.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.7 m -57.27 -35.41 69.73 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.474 176.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.31 -43.89 69.41 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.903 0.382 . . . . 0.0 110.218 174.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . 0.427 ' C ' ' H ' ' A' ' 545' ' ' TYR . 83.1 mt-10 -60.9 -36.43 79.23 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.09 0.956 . . . . 0.0 113.084 -177.887 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -72.48 23.81 0.06 Allowed 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . 0.433 ' CD2' ' HE3' ' A' ' 478' ' ' LYS . 50.7 t80 -65.92 147.16 53.8 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.137 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -87.59 173.67 8.91 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -173.199 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . 0.451 ' C ' ' H ' ' A' ' 549' ' ' ASP . 7.7 mp -80.53 21.42 0.64 Allowed 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -174.234 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 23.2 p-10 -77.02 22.78 0.19 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.197 0.599 . . . . 0.0 111.98 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . 0.451 ' H ' ' C ' ' A' ' 547' ' ' LEU . 23.0 m-20 -63.67 3.84 0.32 Allowed 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 127.148 2.179 . . . . 0.0 115.181 -175.365 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.428 ' HB3' ' HD2' ' A' ' 551' ' ' PRO . 47.0 mt-10 -60.26 151.57 67.19 Favored Pre-proline 0 C--N 1.308 -1.199 0 CA-C-O 118.789 -0.624 . . . . 0.0 109.74 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . 0.428 ' HD2' ' HB3' ' A' ' 550' ' ' GLU . 1.9 Cg_exo 8.99 74.71 0.0 OUTLIER 'Trans proline' 0 C--N 1.379 2.179 1 C-N-CA 126.534 4.823 . . . . 0.0 117.032 -164.339 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 56.0 p90 -84.56 5.0 29.46 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.574 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -73.5 10.4 1.06 Allowed 'General case' 0 C--N 1.288 -2.102 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -176.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . 0.444 ' HA ' ' HG3' ' A' ' 583' ' ' ARG . 24.1 p-10 -76.04 -21.66 56.56 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 168.458 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -25.41 -75.38 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 127.322 2.249 . . . . 0.0 113.348 178.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 22.4 pt -61.99 -35.73 70.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 C-N-CA 123.85 0.86 . . . . 0.0 112.432 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.34 -54.11 47.96 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . 0.701 ' HA ' ' CE1' ' A' ' 576' ' ' HIS . 28.7 t70 -63.43 -46.34 86.76 Favored 'General case' 0 C--O 1.201 -1.496 0 CA-C-N 113.897 -1.501 . . . . 0.0 110.909 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.578 ' O ' HG12 ' A' ' 563' ' ' ILE . 75.5 t80 -57.77 -53.3 59.72 Favored 'General case' 0 C--N 1.291 -1.94 0 C-N-CA 123.798 0.839 . . . . 0.0 112.009 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 71.6 t -63.55 -46.63 94.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . 0.462 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 64.4 m-20 -60.32 -47.7 84.9 Favored 'General case' 0 C--O 1.175 -2.842 0 CA-C-O 118.151 -0.928 . . . . 0.0 112.149 177.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . 0.446 ' HA ' ' HG2' ' A' ' 565' ' ' GLU . 55.6 t -60.38 -47.87 90.66 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.991 0 CA-C-N 119.271 0.941 . . . . 0.0 111.289 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.578 HG12 ' O ' ' A' ' 559' ' ' TYR . 38.5 mm -66.03 -32.41 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-O 121.543 0.687 . . . . 0.0 110.321 -176.334 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -92.29 -22.76 19.56 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -175.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.462 ' HG2' ' O ' ' A' ' 561' ' ' ASN . 6.9 pt-20 -85.24 -28.69 25.2 Favored 'General case' 0 CA--C 1.505 -0.76 0 C-N-CA 119.473 -0.891 . . . . 0.0 109.039 -175.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.32 14.67 1.87 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.942 -175.78 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -71.92 -45.26 43.31 Favored Glycine 0 N--CA 1.441 -1.025 0 N-CA-C 109.686 -1.366 . . . . 0.0 109.686 174.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 6.5 pm0 -136.98 -2.17 2.11 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 122.782 0.433 . . . . 0.0 110.724 176.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 66.6 101.92 0.04 OUTLIER 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.507 1.523 . . . . 0.0 109.384 -176.414 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 570' ' ' THR . . . . . 0.52 ' HB ' ' OE1' ' A' ' 572' ' ' GLU . 19.6 p -93.4 -173.88 3.34 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 116.11 1.893 . . . . 0.0 116.11 -167.108 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.0 mt -89.64 -31.62 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.065 0 N-CA-C 104.114 -2.55 . . . . 0.0 104.114 173.91 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . 0.52 ' OE1' ' HB ' ' A' ' 570' ' ' THR . 3.2 mp0 -59.23 -19.1 42.83 Favored 'General case' 0 C--O 1.197 -1.709 0 CA-C-N 112.868 -1.969 . . . . 0.0 110.715 177.025 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 50.3 m -59.56 -41.53 90.34 Favored 'General case' 0 N--CA 1.427 -1.606 0 C-N-CA 123.483 0.713 . . . . 0.0 109.414 174.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 6.4 mp -70.25 -45.55 66.23 Favored 'General case' 0 C--O 1.256 1.444 0 CA-C-O 121.828 0.823 . . . . 0.0 110.182 177.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -59.9 -35.25 74.45 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.052 176.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . 0.701 ' CE1' ' HA ' ' A' ' 558' ' ' ASP . 15.0 t60 -59.61 -41.29 90.03 Favored 'General case' 0 C--O 1.202 -1.435 0 C-N-CA 123.015 0.526 . . . . 0.0 111.184 175.177 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -53.28 -54.85 30.24 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 69.3 mt -64.35 -39.53 94.07 Favored 'General case' 0 CA--C 1.57 1.741 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.818 179.466 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.774 ' O ' ' HB ' ' A' ' 582' ' ' THR . 36.1 ttt180 -64.3 -32.03 73.47 Favored 'General case' 0 C--O 1.264 1.84 0 C-N-CA 124.383 1.073 . . . . 0.0 113.433 176.61 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -67.63 -41.69 83.52 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.106 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . 0.498 ' O ' HD11 ' A' ' 589' ' ' LEU . . . -62.75 -30.55 71.52 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.445 172.609 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.774 ' HB ' ' O ' ' A' ' 579' ' ' ARG . 23.2 m -60.46 -42.83 96.99 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.892 0.877 . . . . 0.0 112.822 -178.498 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.444 ' HG3' ' HA ' ' A' ' 554' ' ' ASN 0.34 20.8 mmm180 -39.75 -31.61 0.11 Allowed 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 120.789 3.625 . . . . 0.0 120.789 -171.868 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 7.2 tp -80.32 -30.1 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 CA-C-N 120.659 1.572 . . . . 0.0 111.573 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 90.03 49.47 3.31 Favored Glycine 0 C--N 1.309 -0.94 0 N-CA-C 116.142 1.217 . . . . 0.0 116.142 174.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -85.15 162.41 19.25 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 172.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 34.4 m -59.18 -39.3 78.31 Favored 'Isoleucine or valine' 0 C--O 1.264 1.833 0 CA-C-N 118.691 0.678 . . . . 0.0 112.239 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.5 ' O ' ' HD1' ' A' ' 592' ' ' TYR . 41.1 mm-40 -67.11 -34.89 78.59 Favored 'General case' 0 CA--C 1.476 -1.89 0 O-C-N 121.312 -0.868 . . . . 0.0 109.235 176.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . 0.498 HD11 ' O ' ' A' ' 581' ' ' ALA . 79.8 mt -73.73 -17.32 61.13 Favored 'General case' 0 N--CA 1.416 -2.164 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.691 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . 0.411 ' O ' ' HB3' ' A' ' 593' ' ' TYR . 51.5 tt0 -64.95 -38.59 91.48 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 167.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.739 ' O ' ' HB3' ' A' ' 594' ' ' LEU . 89.8 mttt -63.13 -34.14 76.96 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-O 123.066 1.413 . . . . 0.0 109.237 172.014 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.546 ' O ' ' HB2' ' A' ' 595' ' ' GLN . 10.9 m-85 -64.26 -39.78 94.63 Favored 'General case' 0 CA--C 1.589 2.467 0 CA-C-O 122.493 1.14 . . . . 0.0 109.612 171.35 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . 0.746 ' HA ' ' NE2' ' A' ' 596' ' ' GLN . 71.5 t80 -58.55 -29.32 66.27 Favored 'General case' 0 CA--C 1.559 1.3 0 O-C-N 121.602 -0.686 . . . . 0.0 110.666 171.038 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . 0.739 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 11.6 tp -58.77 -39.09 79.98 Favored 'General case' 0 C--O 1.211 -0.954 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 170.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . 0.546 ' HB2' ' O ' ' A' ' 592' ' ' TYR . 0.5 OUTLIER -55.04 -36.54 65.64 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.182 173.466 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . 0.746 ' NE2' ' HA ' ' A' ' 593' ' ' TYR . 1.7 mp0 -60.96 -47.72 85.12 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.69 172.56 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.28 -39.24 66.46 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.84 174.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 594' ' ' LEU . 87.9 t -65.3 -40.64 89.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 123.304 0.642 . . . . 0.0 111.059 177.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . 0.516 ' O ' ' HG3' ' A' ' 602' ' ' LYS . . . -61.98 -43.88 97.92 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.076 -0.712 . . . . 0.0 109.076 177.349 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 49.1 tttm -63.89 -39.82 95.06 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 114.834 -1.075 . . . . 0.0 110.049 175.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . 0.585 ' O ' ' HB3' ' A' ' 604' ' ' ARG . 9.0 t30 -64.74 -36.39 84.13 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 123.403 0.681 . . . . 0.0 111.341 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 599' ' ' ALA . 0.0 OUTLIER -73.64 -30.97 63.26 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.235 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -73.64 -19.4 60.86 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.926 0.87 . . . . 0.0 110.439 176.156 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . 0.585 ' HB3' ' O ' ' A' ' 601' ' ' ASN . 65.5 ttt180 -70.88 -13.17 61.93 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 124.614 1.166 . . . . 0.0 109.687 174.537 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 80.4 mmm . . . . . 0 C--O 1.251 1.147 0 C-N-CA 125.798 1.639 . . . . 0.0 110.527 -179.625 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.412 -2.335 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -85.18 -173.27 4.61 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.0 0.428 . . . . 0.0 111.088 -175.119 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -96.7 74.29 2.72 Favored 'General case' 0 N--CA 1.423 -1.808 0 CA-C-O 122.356 1.074 . . . . 0.0 110.248 -176.741 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 73.9 mt -58.07 119.82 7.48 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 113.486 -1.688 . . . . 0.0 107.802 174.54 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 49.6 m -98.67 105.63 17.8 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -167.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -68.09 -40.13 82.72 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 114.504 -1.225 . . . . 0.0 107.95 171.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -59.0 -32.14 69.42 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 113.517 -1.674 . . . . 0.0 110.856 -178.677 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.601 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 38.0 tt0 -67.16 -34.97 78.69 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.211 178.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.48 ' HD3' ' O ' ' A' ' 471' ' ' LYS . 2.2 tmtp? -66.66 -41.6 87.95 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -178.012 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -60.06 -41.29 92.05 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.987 177.281 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . 0.525 ' HB3' ' CZ ' ' A' ' 504' ' ' PHE . 0.3 OUTLIER -66.21 -39.41 89.61 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.386 179.629 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.601 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 98.2 mtt180 -55.08 -45.08 75.37 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.152 0.501 . . . . 0.0 109.83 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -68.14 -42.55 79.94 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.03 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -63.02 -52.81 61.45 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.799 -177.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.79 -40.42 92.53 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 124.007 0.817 . . . . 0.0 109.865 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 19.5 tttp -49.17 -70.69 0.08 Allowed 'General case' 0 C--O 1.221 -0.425 0 O-C-N 123.888 0.742 . . . . 0.0 111.994 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . 0.26 16.6 m170 27.97 -100.92 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 115.324 1.602 . . . . 0.0 115.324 -174.268 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 78.9 mt -166.46 179.95 5.27 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 126.084 1.754 . . . . 0.0 106.762 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 1.4 pmm? -75.93 -8.41 56.85 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.783 0.802 . . . . 0.0 110.293 178.091 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -63.08 -47.24 83.73 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 124.76 1.224 . . . . 0.0 110.392 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.442 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 3.3 m-20 -71.34 43.71 0.08 Allowed 'General case' 0 C--N 1.285 -2.203 0 C-N-CA 126.647 1.979 . . . . 0.0 115.78 -172.567 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -67.57 -39.77 84.91 Favored 'General case' 0 C--O 1.247 0.929 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.21 -52.53 65.17 Favored 'General case' 0 C--O 1.205 -1.282 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.242 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.442 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 3.4 m -56.92 -42.73 80.51 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 124.661 1.184 . . . . 0.0 111.22 -177.38 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . 0.466 ' CE1' ' HE2' ' A' ' 491' ' ' TYR . 84.0 t80 -51.3 -56.61 12.11 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.637 0.775 . . . . 0.0 109.719 175.483 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 63.7 mt -74.81 -28.3 60.66 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 122.085 -0.384 . . . . 0.0 111.341 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -69.81 -27.12 64.62 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.288 0.566 . . . . 0.0 110.859 -177.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.22 -40.31 19.79 Favored 'General case' 0 N--CA 1.414 -2.233 0 C-N-CA 120.084 -0.646 . . . . 0.0 109.318 177.28 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . 0.466 ' HE2' ' CE1' ' A' ' 487' ' ' PHE . 42.1 m-85 -58.01 -32.64 68.13 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -77.71 -38.85 46.41 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.607 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 17.8 t -87.23 -39.28 15.58 Favored 'General case' 0 C--O 1.249 1.074 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -173.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 41.9 t -92.97 166.66 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 -175.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -80.27 117.39 21.0 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -67.96 -44.37 76.87 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.078 -176.399 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.07 -53.86 47.03 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 -169.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -76.69 -35.0 58.17 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.176 -174.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . 0.432 ' CZ ' HG22 ' A' ' 563' ' ' ILE 0.262 37.2 m-85 -78.6 -15.25 58.75 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -178.357 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 57.4 m -77.04 86.91 3.54 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 118.737 -1.185 . . . . 0.0 108.379 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -84.45 -178.2 6.84 Favored 'General case' 0 C--O 1.208 -1.112 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -63.15 -35.38 80.1 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.309 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -59.31 -56.92 15.9 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.565 -1.652 . . . . 0.0 108.422 177.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . 0.525 ' CZ ' ' HB3' ' A' ' 473' ' ' GLU 0.309 57.6 m-85 -66.73 -26.83 67.19 Favored 'General case' 0 N--CA 1.421 -1.88 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 178.865 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 36.1 tttm -63.0 -47.6 82.41 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 175.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.565 ' O ' HG22 ' A' ' 510' ' ' VAL . 9.2 m-85 -52.51 -60.7 2.92 Favored 'General case' 0 N--CA 1.439 -1.022 0 O-C-N 124.506 1.129 . . . . 0.0 110.937 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . 0.406 HG23 ' HA ' ' A' ' 504' ' ' PHE . 22.7 m -65.45 -44.81 94.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -50.49 -51.83 43.7 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.094 0.557 . . . . 0.0 110.604 176.164 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -57.74 -51.93 67.52 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.541 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 506' ' ' TYR . 21.8 t -62.42 -47.6 92.26 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 O-C-N 123.475 0.484 . . . . 0.0 111.764 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.449 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 3.8 tt -68.2 -41.33 81.53 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.859 -174.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -66.53 -41.98 87.94 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.376 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -64.23 -49.33 72.36 Favored 'General case' 0 CA--C 1.501 -0.907 0 C-N-CA 123.272 0.629 . . . . 0.0 110.763 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -61.63 -46.96 87.54 Favored 'General case' 0 C--O 1.177 -2.738 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.946 177.073 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . 0.449 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 0.5 OUTLIER -48.29 -39.94 23.32 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.761 0.824 . . . . 0.0 110.0 -179.323 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.15 -56.52 5.92 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.467 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -95.48 -11.06 28.14 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -169.046 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -150.96 -151.29 0.38 Allowed 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 106.449 -1.686 . . . . 0.0 106.449 -175.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -97.38 -162.95 1.0 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 176.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -83.77 -170.69 3.2 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 118.431 0.56 . . . . 0.0 112.299 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -41.69 118.78 1.15 Allowed 'General case' 0 N--CA 1.418 -2.069 0 N-CA-C 115.559 1.689 . . . . 0.0 115.559 -178.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -107.27 111.55 23.98 Favored 'General case' 0 N--CA 1.415 -2.194 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 172.704 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 30.7 pt -54.78 -28.04 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.098 1.359 . . . . 0.0 112.901 -174.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 10.2 m -58.51 -31.52 67.96 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.563 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -36.65 77.91 Favored 'General case' 0 C--O 1.245 0.852 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . 0.622 ' HA ' ' CD2' ' A' ' 529' ' ' TYR . . . -61.52 -35.6 78.18 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.04 178.336 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 52.3 t -67.91 -34.86 69.71 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.496 0 C-N-CA 124.381 1.072 . . . . 0.0 108.996 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -66.44 -20.74 66.13 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.051 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.622 ' CD2' ' HA ' ' A' ' 526' ' ' ALA . 18.9 m-85 -74.65 7.14 3.22 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.172 173.33 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.446 ' HA ' ' CB ' ' A' ' 536' ' ' ARG . 8.1 p -72.9 14.25 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.625 0 CA-C-O 122.334 1.064 . . . . 0.0 110.411 173.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . 0.47 ' H ' ' C ' ' A' ' 529' ' ' TYR . 46.3 m-80 -101.35 -21.18 14.91 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.584 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 532' ' ' SER . . . . . 0.542 ' OG ' ' HB2' ' A' ' 535' ' ' LEU . 80.9 p -83.91 157.89 21.79 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -63.5 -61.92 2.01 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -94.23 -40.5 9.97 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -173.789 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.542 ' HB2' ' OG ' ' A' ' 532' ' ' SER . 99.5 mt -62.99 -22.66 67.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -174.79 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . 0.446 ' CB ' ' HA ' ' A' ' 530' ' ' VAL . 18.0 ptp180 -59.61 -42.84 93.54 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.428 0.632 . . . . 0.0 109.567 177.179 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -70.53 -56.53 6.33 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.274 -177.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.459 ' O ' HD13 ' A' ' 542' ' ' LEU . 12.9 m -59.12 -53.65 55.92 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.375 -176.486 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . 0.432 ' HB3' ' HB2' ' A' ' 526' ' ' ALA 0.262 4.4 mm? -61.72 -38.91 89.63 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.232 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . 0.574 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 69.4 mt -69.04 -36.77 75.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.052 176.665 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 57.5 m -56.17 -43.52 78.46 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.524 0.678 . . . . 0.0 109.617 173.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 538' ' ' THR . 8.8 mp -65.63 -31.23 72.15 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.114 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -70.9 -41.42 71.3 Favored 'General case' 0 C--N 1.317 -0.844 0 O-C-N 122.086 -0.384 . . . . 0.0 110.772 177.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . 0.574 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 76.5 mt-30 -69.9 -27.87 65.15 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.195 -177.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -67.48 118.59 11.02 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 174.351 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -124.7 130.67 52.85 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -168.165 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 61.9 tp -75.24 -27.89 59.66 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.956 -178.15 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -73.17 -36.81 66.67 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.806 -0.357 . . . . 0.0 111.058 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -68.73 -55.25 11.96 Favored 'General case' 0 CA--C 1.508 -0.673 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.382 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.53 114.5 25.26 Favored Pre-proline 0 C--N 1.298 -1.654 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.74 151.74 74.49 Favored 'Trans proline' 0 C--O 1.249 1.041 0 C-N-CA 122.585 2.19 . . . . 0.0 111.333 175.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -126.89 49.86 2.02 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.824 0.821 . . . . 0.0 111.307 -174.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.96 -12.63 60.0 Favored 'General case' 0 C--N 1.285 -2.23 0 CA-C-O 121.667 0.746 . . . . 0.0 112.314 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -79.29 -22.29 44.84 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 124.489 1.116 . . . . 0.0 108.789 173.477 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -39.07 -69.36 0.13 Allowed 'General case' 0 C--O 1.199 -1.56 0 C-N-CA 125.331 1.453 . . . . 0.0 111.585 -175.655 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 38.8 pt -54.1 -39.68 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 123.724 0.64 . . . . 0.0 112.193 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.35 -55.01 36.47 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.951 0.9 . . . . 0.0 110.995 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -73.96 -35.89 64.56 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.326 -175.58 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.612 ' CE1' HD13 ' A' ' 563' ' ' ILE . 93.4 t80 -57.25 -52.74 64.11 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 125.164 1.386 . . . . 0.0 111.648 177.977 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 14.4 p -64.21 -38.37 82.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 109.811 -0.441 . . . . 0.0 109.811 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . 0.48 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 27.1 t-20 -61.76 -45.41 94.02 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.476 178.422 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.54 -50.47 34.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -178.27 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.612 HD13 ' CE1' ' A' ' 559' ' ' TYR . 30.5 mt -95.85 -45.74 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.118 0 CA-C-O 121.793 0.806 . . . . 0.0 111.638 -167.897 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -81.24 6.75 13.11 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 122.485 1.136 . . . . 0.0 108.076 -175.11 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.48 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 4.2 tm-20 -57.91 -39.12 77.16 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 169.309 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -81.04 54.97 2.35 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.955 -1.475 . . . . 0.0 113.145 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . 173.91 66.63 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 118.79 -1.671 . . . . 0.0 115.215 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -118.78 142.9 47.27 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 117.832 0.816 . . . . 0.0 109.126 173.249 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -116.64 -38.91 3.39 Favored 'General case' 0 C--N 1.301 -1.541 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.935 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 570' ' ' THR . . . . . 0.458 HG22 ' N ' ' A' ' 571' ' ' ILE . 94.5 m -129.07 161.67 29.46 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 123.163 0.585 . . . . 0.0 109.579 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . 0.458 ' N ' HG22 ' A' ' 570' ' ' THR . 11.8 tt -54.89 -44.96 75.03 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 C-N-CA 123.987 0.915 . . . . 0.0 111.253 175.293 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 30.9 mt-10 -67.52 -23.73 65.48 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-O 119.042 -0.504 . . . . 0.0 112.099 177.014 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 8.4 m -62.28 -34.28 76.25 Favored 'General case' 0 C--O 1.206 -1.218 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 72.0 mt -60.95 -56.85 16.22 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 175.089 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . 0.47 ' O ' ' HG3' ' A' ' 579' ' ' ARG . 14.4 m120 -59.64 -51.56 69.28 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.576 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -60.33 -39.51 87.31 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.045 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -61.27 -48.12 82.87 Favored 'General case' 0 CA--C 1.508 -0.666 0 O-C-N 123.531 0.519 . . . . 0.0 110.483 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 96.1 mt -57.74 -48.55 79.3 Favored 'General case' 0 CA--C 1.516 -0.33 0 O-C-N 123.663 0.602 . . . . 0.0 109.984 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.47 ' HG3' ' O ' ' A' ' 575' ' ' ASN . 98.4 mtt180 -60.17 -57.85 11.04 Favored 'General case' 0 C--O 1.182 -2.48 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.667 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -70.45 -34.33 72.32 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -66.1 -56.48 11.28 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.001 0.905 . . . . 0.0 110.382 175.596 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 582' ' ' THR . . . . . . . . . . . . . 3.6 m -68.39 -21.34 64.7 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 126.084 1.753 . . . . 0.0 111.843 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -24.22 -59.86 0.05 Allowed 'General case' 0 CA--C 1.479 -1.752 0 C-N-CA 130.57 3.548 . . . . 0.0 117.587 -163.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . 0.476 ' HB ' ' HA ' ' A' ' 587' ' ' VAL . 46.7 pt -84.62 -52.62 12.3 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.535 0 C-N-CA 116.99 -1.884 . . . . 0.0 112.752 -175.583 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 65.59 -57.37 0.13 Allowed Glycine 0 CA--C 1.548 2.128 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 -170.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . 0.424 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 20.2 t70 -144.36 115.64 8.0 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 103.725 -2.695 . . . . 0.0 103.725 172.844 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.476 ' HA ' ' HB ' ' A' ' 584' ' ' ILE 0.349 11.2 p -30.14 -87.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.575 1.911 0 N-CA-C 118.555 2.798 . . . . 0.0 118.555 -163.809 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.501 ' O ' ' HG2' ' A' ' 591' ' ' LYS . 69.8 mm-40 -69.66 -62.03 1.55 Allowed 'General case' 0 C--O 1.268 2.029 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 -170.909 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 41.9 tp -67.27 -52.21 43.53 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.416 -170.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . 0.424 ' HB3' ' O ' ' A' ' 586' ' ' ASP . 57.3 tp60 -64.48 -34.41 78.14 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-O 118.408 -0.806 . . . . 0.0 112.586 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.501 ' HG2' ' O ' ' A' ' 588' ' ' GLU . 21.4 pttm -60.23 -39.13 85.56 Favored 'General case' 0 C--N 1.374 1.658 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.705 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -59.39 -55.03 39.82 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.502 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -63.94 -41.01 97.73 Favored 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . 0.435 ' O ' HG22 ' A' ' 598' ' ' VAL . 3.5 tm? -57.22 -50.96 71.24 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 122.426 0.29 . . . . 0.0 110.857 -177.739 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -30.65 70.39 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.381 -178.046 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . 0.579 HE21 ' HA ' ' A' ' 596' ' ' GLN . 0.0 OUTLIER -66.15 -50.48 63.82 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.964 176.527 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 1.7 mp -56.05 -50.0 72.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.436 177.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . 0.435 HG22 ' O ' ' A' ' 594' ' ' LEU . 26.1 t -66.5 -33.03 60.76 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.259 0 CA-C-O 120.917 0.389 . . . . 0.0 111.123 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -65.77 -45.23 83.26 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.903 0.382 . . . . 0.0 110.382 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.09 -32.96 74.73 Favored 'General case' 0 C--O 1.214 -0.787 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.203 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -63.15 -40.04 96.41 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.657 0.741 . . . . 0.0 109.408 175.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . . . . . . . . . 12.0 tmtt? -68.75 -47.89 65.11 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.825 -1.079 . . . . 0.0 110.92 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -75.08 -7.63 54.27 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 178.082 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -67.14 -40.18 86.68 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 175.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 24.9 ttt . . . . . 0 C--O 1.253 1.266 0 O-C-N 124.791 1.307 . . . . 0.0 111.074 175.524 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -86.03 108.83 18.42 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.112 -1.069 . . . . 0.0 108.112 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -88.17 65.71 8.22 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 122.055 0.931 . . . . 0.0 110.604 -176.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . 0.527 ' O ' HD13 ' A' ' 466' ' ' LEU . 3.2 pp -74.98 107.64 7.18 Favored 'General case' 0 N--CA 1.417 -2.091 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.156 169.171 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 467' ' ' SER . . . . . 0.513 ' HB2' ' OE1' ' A' ' 469' ' ' GLN . 4.0 p -109.64 162.86 14.02 Favored 'General case' 0 C--N 1.279 -2.496 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -176.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . 0.539 ' O ' ' HB2' ' A' ' 471' ' ' LYS . 4.3 ptp180 -64.93 -18.08 64.92 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.252 0.548 . . . . 0.0 112.076 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.513 ' OE1' ' HB2' ' A' ' 467' ' ' SER . 26.3 mp0 -65.15 -27.23 68.57 Favored 'General case' 0 C--N 1.31 -1.122 0 O-C-N 122.072 -0.393 . . . . 0.0 111.922 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.412 ' HA ' ' OE1' ' A' ' 473' ' ' GLU . 2.3 mp0 -67.02 -25.46 66.3 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 120.983 0.421 . . . . 0.0 111.274 173.289 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.539 ' HB2' ' O ' ' A' ' 468' ' ' ARG . 16.6 mmtp -67.94 -41.1 83.07 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 173.397 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -65.23 -46.24 81.45 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.368 178.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . 0.576 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 50.1 mt-10 -54.28 -58.46 7.3 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 175.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 41.3 ttt-85 -51.37 -35.26 37.75 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . 0.614 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -62.27 -51.85 66.08 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -63.51 -44.34 94.59 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.71 0.767 . . . . 0.0 112.056 176.17 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . 0.576 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 61.2 mt -73.4 -9.02 58.26 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 -173.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.614 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 24.7 pttm -74.38 -0.6 17.79 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.596 -0.69 . . . . 0.0 112.164 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . 0.408 ' HB2' ' OD1' ' A' ' 483' ' ' ASP . 6.2 p80 -142.75 108.76 5.19 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 124.118 0.967 . . . . 0.0 108.81 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.401 ' O ' ' HB3' ' A' ' 520' ' ' GLN . 93.0 mt -138.04 8.03 2.71 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -172.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 82.9 mtp -94.49 -66.16 0.93 Allowed 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 119.714 -0.795 . . . . 0.0 111.743 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -71.9 -29.15 64.03 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 122.685 1.231 . . . . 0.0 109.862 177.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.53 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 9.3 m-20 -71.11 51.52 0.16 Allowed 'General case' 0 C--N 1.288 -2.091 0 C-N-CA 127.834 2.453 . . . . 0.0 115.424 -172.624 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -66.19 -39.61 89.83 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -55.26 -46.05 76.12 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-N 114.045 -1.434 . . . . 0.0 109.538 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.53 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 23.5 m -65.53 -40.98 93.55 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 123.494 0.718 . . . . 0.0 111.774 -177.506 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . 0.404 ' O ' ' HD1' ' A' ' 491' ' ' TYR . 37.8 t80 -60.49 -47.65 85.23 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 4.2 mm? -69.05 -31.57 70.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.904 178.225 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -72.11 -23.82 61.39 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.268 0.556 . . . . 0.0 110.145 177.317 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -83.48 -23.69 32.09 Favored 'General case' 0 N--CA 1.388 -3.555 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . 0.468 ' HB2' ' O ' ' A' ' 488' ' ' LEU . 28.9 m-85 -62.2 -42.38 99.24 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 167.625 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -70.84 -44.18 67.0 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.21 -0.905 . . . . 0.0 111.556 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 19.8 m -78.33 -8.87 58.92 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -174.712 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 87.4 t -122.17 107.83 20.58 Favored 'Isoleucine or valine' 0 C--O 1.249 1.04 0 CA-C-O 121.14 0.495 . . . . 0.0 110.753 -177.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . 0.272 6.9 p30 -150.67 -84.04 0.09 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 178.687 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.463 ' C ' ' H ' ' A' ' 498' ' ' ASN . 4.0 mptp? -76.73 -13.91 59.99 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.801 0.81 . . . . 0.0 112.059 -177.424 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -72.46 23.91 0.05 Allowed 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 125.977 1.711 . . . . 0.0 111.533 173.415 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . 0.463 ' H ' ' C ' ' A' ' 496' ' ' LYS . 4.2 p-10 -77.72 18.08 0.49 Allowed 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 123.722 0.809 . . . . 0.0 112.092 -176.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . 0.411 ' CE1' ' HD3' ' A' ' 566' ' ' LYS . 23.4 p90 -77.79 -22.56 49.94 Favored 'General case' 0 C--O 1.244 0.809 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 175.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 500' ' ' THR . . . . . 0.515 ' HB ' ' CE2' ' A' ' 504' ' ' PHE . 3.9 m -67.48 156.57 36.31 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.088 -1.414 . . . . 0.0 109.56 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.539 ' C ' ' H ' ' A' ' 503' ' ' HIS . 28.4 t-20 -65.72 164.36 14.7 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 124.496 1.118 . . . . 0.0 111.866 -175.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . 0.51 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 7.8 pt20 -58.6 14.32 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 127.201 2.2 . . . . 0.0 113.85 177.731 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . 0.539 ' H ' ' C ' ' A' ' 501' ' ' ASN . 7.8 t-160 -64.3 -55.47 21.13 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -174.323 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . 0.515 ' CE2' ' HB ' ' A' ' 500' ' ' THR . 0.1 OUTLIER -61.18 -24.18 66.12 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.141 -1.39 . . . . 0.0 114.069 174.824 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.51 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 45.3 tttp -62.14 -52.07 65.31 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.497 ' O ' HG21 ' A' ' 510' ' ' VAL 0.319 2.8 m-85 -69.12 -29.68 67.79 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 178.524 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . 0.41 HG22 ' O ' ' A' ' 503' ' ' HIS . 82.2 t -63.25 -53.7 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.793 175.353 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -50.09 -53.88 24.23 Favored 'General case' 0 C--O 1.2 -1.536 0 O-C-N 123.166 0.291 . . . . 0.0 111.22 175.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -57.63 -60.05 4.26 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.941 1.46 . . . . 0.0 114.941 -176.737 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.497 HG21 ' O ' ' A' ' 506' ' ' TYR . 10.9 t -61.81 -43.38 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.478 -176.381 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 10.4 mp -66.64 -49.13 67.24 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.753 -177.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -61.74 -46.92 87.54 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 123.358 0.663 . . . . 0.0 110.047 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -55.88 -48.67 75.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.951 0.5 . . . . 0.0 111.722 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -70.82 -45.14 65.12 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.94 -178.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -52.59 -39.59 61.75 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 124.772 1.229 . . . . 0.0 109.434 175.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -64.63 -21.37 66.7 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.046 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -106.55 -56.46 2.19 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 121.056 0.455 . . . . 0.0 111.141 -178.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -117.58 -154.41 0.56 Allowed 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -173.158 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . 0.449 ' CG ' ' H ' ' A' ' 520' ' ' GLN . 16.9 t70 -87.22 -159.82 0.54 Allowed 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 125.849 1.659 . . . . 0.0 107.984 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . 0.449 ' H ' ' CG ' ' A' ' 519' ' ' ASP . 77.4 mm-40 -79.22 155.28 28.67 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -170.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -41.88 134.2 2.67 Favored 'General case' 0 N--CA 1.407 -2.597 0 C-N-CA 128.025 2.53 . . . . 0.0 116.255 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -118.1 158.49 24.93 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 106.308 -1.738 . . . . 0.0 106.308 173.196 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 45.3 pt -68.48 -23.37 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-O 121.583 0.706 . . . . 0.0 109.417 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 3.0 m -56.35 -40.06 73.87 Favored 'General case' 0 N--CA 1.417 -2.109 0 C-N-CA 125.166 1.386 . . . . 0.0 110.891 177.566 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . 0.423 ' O ' ' HB3' ' A' ' 528' ' ' GLN . 15.9 m-20 -68.4 -33.88 75.02 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.328 0.585 . . . . 0.0 110.4 179.347 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -64.18 -47.89 78.07 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.642 177.235 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 7.6 p -70.86 -18.22 20.72 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.106 0 CA-C-O 121.77 0.795 . . . . 0.0 110.374 176.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . 0.423 ' HB3' ' O ' ' A' ' 525' ' ' ASP . 0.7 OUTLIER -68.17 -31.58 71.23 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 172.58 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.581 ' HB3' ' HG3' ' A' ' 536' ' ' ARG . 0.5 OUTLIER -85.21 11.38 10.07 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.764 175.223 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.565 ' HA ' ' CZ ' ' A' ' 536' ' ' ARG . 2.9 p -72.94 4.98 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -171.572 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -109.0 -35.99 6.2 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 119.948 -1.72 . . . . 0.0 110.749 176.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 532' ' ' SER . . . . . 0.567 ' O ' ' HG3' ' A' ' 534' ' ' GLU . 24.5 t -80.44 -145.2 0.05 OUTLIER 'General case' 0 CA--C 1.583 2.221 0 CA-C-N 114.474 -1.239 . . . . 0.0 110.342 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . 0.581 ' C ' ' H ' ' A' ' 535' ' ' LEU 0.574 5.3 t-20 -25.34 39.02 0.0 OUTLIER 'General case' 0 CA--C 1.465 -2.325 1 C-N-CA 137.084 6.154 . . . . 0.0 121.61 179.905 . . . . . . . . 4 3 . 1 . 011 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . 0.584 ' HA ' ' CD ' ' A' ' 536' ' ' ARG . 45.9 mt-10 -28.97 6.41 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.813 0 C-N-CA 129.19 2.996 . . . . 0.0 117.384 -177.592 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.581 ' H ' ' C ' ' A' ' 533' ' ' ASN . 1.0 OUTLIER -72.06 -21.48 61.51 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 162.411 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . 0.584 ' CD ' ' HA ' ' A' ' 534' ' ' GLU . 0.0 OUTLIER -69.59 -18.26 63.6 Favored 'General case' 0 C--N 1.383 2.052 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 172.222 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . 0.56 ' N ' ' HD3' ' A' ' 536' ' ' ARG . 6.1 tp10 -76.95 -41.26 43.96 Favored 'General case' 0 CA--C 1.47 -2.117 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 -178.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.457 ' O ' HD11 ' A' ' 542' ' ' LEU . 27.6 m -54.96 -47.64 74.26 Favored 'General case' 0 N--CA 1.442 -0.873 0 O-C-N 124.05 0.844 . . . . 0.0 108.849 172.352 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 59.5 tp -56.48 -48.18 77.68 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.267 177.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 536' ' ' ARG . 57.5 mt -63.72 -41.08 91.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-O 120.744 0.307 . . . . 0.0 110.729 178.603 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.2 m -56.99 -46.44 82.24 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.684 0.754 . . . . 0.0 109.993 174.331 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.457 HD11 ' O ' ' A' ' 538' ' ' THR . 6.0 mp -67.53 -16.15 64.04 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 124.43 1.092 . . . . 0.0 112.652 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -88.26 -39.85 14.11 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 177.099 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -67.09 -36.78 82.71 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -68.27 129.18 39.16 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 170.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -74.95 109.06 8.09 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 122.382 1.087 . . . . 0.0 112.189 -168.531 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -78.96 -13.93 59.51 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 113.3 -1.773 . . . . 0.0 113.505 -177.215 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -75.94 -6.98 53.48 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.114 0.483 . . . . 0.0 110.666 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -72.59 -8.33 54.67 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.888 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -87.69 149.02 45.25 Favored Pre-proline 0 C--N 1.312 -1.054 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . 0.426 ' O ' ' HB2' ' A' ' 554' ' ' ASN . 23.2 Cg_exo -66.84 129.43 20.87 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.035 1.823 . . . . 0.0 107.99 172.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . 0.56 ' O ' ' HG2' ' A' ' 555' ' ' GLU . 21.6 t80 -82.84 -6.09 59.28 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 121.937 0.875 . . . . 0.0 111.23 -172.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -82.88 -8.63 59.56 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-O 121.773 0.797 . . . . 0.0 111.502 172.198 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . 0.426 ' HB2' ' O ' ' A' ' 551' ' ' PRO . 6.6 m-20 -73.04 -22.89 60.55 Favored 'General case' 0 C--O 1.198 -1.622 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.357 177.076 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . 0.56 ' HG2' ' O ' ' A' ' 552' ' ' TYR . 18.6 mm-40 -40.0 -83.65 0.01 OUTLIER 'General case' 0 C--O 1.196 -1.73 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -164.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 0.6 OUTLIER -67.59 -39.27 82.0 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-O 121.573 0.701 . . . . 0.0 110.037 -176.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.88 -59.81 4.85 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.341 -173.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -73.83 -39.25 64.17 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.147 -176.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.508 ' O ' HG13 ' A' ' 563' ' ' ILE . 93.5 t80 -50.34 -53.34 29.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.257 1.023 . . . . 0.0 111.018 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . 0.459 ' O ' ' HB2' ' A' ' 564' ' ' ASN . 53.4 t -64.69 -40.35 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.768 179.32 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . 0.429 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 2.4 t-20 -59.04 -45.92 89.52 Favored 'General case' 0 C--O 1.194 -1.833 0 CA-C-O 119.331 -0.366 . . . . 0.0 110.58 175.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . 0.496 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 91.2 t -66.17 -33.15 61.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.508 HG13 ' O ' ' A' ' 559' ' ' TYR . 14.4 mt -87.09 -31.74 6.12 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.983 0 C-N-CA 118.205 -1.398 . . . . 0.0 108.907 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . 0.459 ' HB2' ' O ' ' A' ' 560' ' ' VAL . 78.5 m-20 -83.53 -2.25 55.56 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.638 176.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.496 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 11.4 tp10 -73.6 -11.17 60.34 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 113.761 -1.563 . . . . 0.0 107.462 175.21 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . 0.411 ' HD3' ' CE1' ' A' ' 499' ' ' PHE . 38.4 ttpt -56.87 -35.11 68.53 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.047 172.976 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -113.66 -55.75 0.42 Allowed Glycine 0 N--CA 1.435 -1.379 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.934 -178.047 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . 0.431 ' HA ' ' CD ' ' A' ' 572' ' ' GLU . 8.7 tt0 55.7 90.92 0.03 OUTLIER 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.781 0.832 . . . . 0.0 110.427 -173.525 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -170.54 -34.87 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.67 -174.165 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 76.8 m -166.91 -19.08 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.168 0 CA-C-O 121.739 0.78 . . . . 0.0 110.854 -168.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -86.35 -19.44 8.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.268 0 CA-C-O 122.191 0.996 . . . . 0.0 109.14 -171.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . 0.431 ' CD ' ' HA ' ' A' ' 568' ' ' GLN . 1.5 mp0 -71.1 -12.8 61.7 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.112 174.617 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 573' ' ' SER . . . . . 0.484 ' O ' ' HB2' ' A' ' 576' ' ' HIS . 22.5 t -62.99 -25.95 68.62 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 107.667 -1.235 . . . . 0.0 107.667 172.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . 0.401 ' O ' ' HG ' ' A' ' 578' ' ' LEU . 9.3 mp -63.5 -32.86 74.43 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 121.017 0.437 . . . . 0.0 110.634 172.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -64.19 -34.73 78.76 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 121.657 0.741 . . . . 0.0 109.626 174.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . 0.484 ' HB2' ' O ' ' A' ' 573' ' ' SER . 13.4 m-70 -60.72 -44.88 96.08 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.388 175.163 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -57.18 -47.81 80.31 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.854 176.203 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.474 ' O ' ' HB ' ' A' ' 582' ' ' THR . 89.1 mt -52.84 -45.08 67.19 Favored 'General case' 0 CA--C 1.492 -1.288 0 C-N-CA 123.231 0.612 . . . . 0.0 111.105 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.669 ' O ' ' HG2' ' A' ' 583' ' ' ARG . 0.0 OUTLIER -59.48 -57.16 14.2 Favored 'General case' 0 C--O 1.199 -1.556 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.35 179.313 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . 0.517 ' HG3' ' NH2' ' A' ' 579' ' ' ARG . 15.0 tt0 -73.41 -36.04 65.93 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -170.452 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -68.05 -46.21 71.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-O 121.472 0.654 . . . . 0.0 110.837 175.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.474 ' HB ' ' O ' ' A' ' 578' ' ' LEU . 84.9 m -88.71 -40.55 13.17 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 119.543 3.164 . . . . 0.0 119.543 -170.725 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.669 ' HG2' ' O ' ' A' ' 579' ' ' ARG . 0.6 OUTLIER -43.21 -85.19 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 -159.1 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . 0.575 ' C ' ' H ' ' A' ' 586' ' ' ASP . 12.8 pt -121.64 -17.33 5.63 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.873 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -174.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 74.13 -37.98 0.96 Allowed Glycine 0 CA--C 1.573 3.684 0 CA-C-O 122.468 1.038 . . . . 0.0 110.908 -166.41 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . 0.575 ' H ' ' C ' ' A' ' 584' ' ' ILE . 23.9 t70 -72.68 173.73 8.6 Favored 'General case' 0 C--O 1.194 -1.855 0 C-N-CA 131.63 3.972 . . . . 0.0 107.745 174.456 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.502 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 7.5 p -27.03 23.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.61 3.263 1 C-N-CA 132.85 4.46 . . . . 0.0 118.675 -174.796 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.538 ' HA ' ' HB2' ' A' ' 591' ' ' LYS 0.352 12.9 pt-20 -55.05 7.41 0.01 OUTLIER 'General case' 0 C--N 1.262 -3.209 0 N-CA-C 117.468 2.396 . . . . 0.0 117.468 179.465 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . 0.568 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 59.0 tp -71.5 -41.33 69.42 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 162.494 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . 0.502 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 0.1 OUTLIER -55.07 -49.73 70.93 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 105.165 -2.161 . . . . 0.0 105.165 167.215 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.642 ' O ' ' HB3' ' A' ' 594' ' ' LEU 0.252 33.6 mmtp -72.95 -9.05 58.3 Favored 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 177.555 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.568 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 82.0 t80 -63.26 -39.56 94.94 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 170.426 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -54.74 -39.43 68.29 Favored 'General case' 0 CA--C 1.553 1.094 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.164 171.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . 0.642 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 10.2 tp -54.31 -46.25 72.78 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 121.57 0.7 . . . . 0.0 109.463 175.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . 0.417 ' HB2' ' HD3' ' A' ' 579' ' ' ARG . 35.1 tt0 -60.82 -37.48 82.16 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 114.253 -1.339 . . . . 0.0 110.999 -176.23 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . 0.479 ' O ' ' HD3' ' A' ' 600' ' ' LYS . 82.0 mm-40 -63.45 -47.87 80.06 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 175.334 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 84.8 mt -54.12 -52.64 35.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.262 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 97.9 t -63.99 -47.37 90.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . 0.406 ' O ' ' HG2' ' A' ' 603' ' ' GLU . . . -61.23 -41.38 96.77 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 118.296 0.498 . . . . 0.0 110.523 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . 0.479 ' HD3' ' O ' ' A' ' 596' ' ' GLN . 1.4 mptm? -67.18 -37.92 84.51 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.029 176.546 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 99.0 m-20 -71.81 -21.97 61.63 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 177.253 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.73 -47.97 56.92 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 123.635 0.774 . . . . 0.0 109.451 177.514 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . 0.406 ' HG2' ' O ' ' A' ' 599' ' ' ALA . 4.7 pt-20 -75.72 -19.62 58.95 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.757 0.789 . . . . 0.0 110.477 177.773 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 600' ' ' LYS . 75.8 ttt180 -77.74 -8.69 58.33 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.01 0.924 . . . . 0.0 109.691 178.142 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 15.2 tpt . . . . . 0 C--N 1.309 -1.175 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -177.443 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 . . . . . 0 C--O 1.241 0.628 0 CA-C-O 120.793 0.33 . . . . 0.0 110.794 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -81.15 163.65 22.94 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -133.98 83.82 2.07 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -178.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 89.8 mt -63.13 120.93 12.41 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.763 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 37.0 t -88.95 106.57 18.5 Favored 'General case' 0 N--CA 1.421 -1.906 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -66.96 -36.93 83.31 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.432 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -68.23 -45.11 74.17 Favored 'General case' 0 C--O 1.198 -1.644 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.743 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -66.26 -22.85 66.32 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -177.262 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.407 ' HD3' ' C ' ' A' ' 471' ' ' LYS . 10.1 tmtt? -76.9 -37.39 55.54 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 172.738 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . 0.445 ' O ' ' HE2' ' A' ' 559' ' ' TYR . . . -64.22 -51.82 61.81 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.31 178.273 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . 0.556 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 2.2 mp0 -53.42 -43.1 67.71 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 118.079 0.4 . . . . 0.0 110.961 176.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 61.5 mtt85 -53.82 -41.95 67.91 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 120.853 0.359 . . . . 0.0 111.183 172.447 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . 0.473 ' O ' ' HB3' ' A' ' 478' ' ' LYS . . . -71.23 -28.56 64.28 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 122.965 0.506 . . . . 0.0 112.317 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -35.06 79.68 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.663 -0.648 . . . . 0.0 110.171 176.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . 0.556 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 45.9 mt -64.05 -8.99 13.56 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 124.61 1.164 . . . . 0.0 112.178 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.473 ' HB3' ' O ' ' A' ' 475' ' ' ALA . 80.3 tttt -71.31 -3.96 23.44 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.656 1.582 . . . . 0.0 111.804 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . 0.409 ' CB ' ' HB2' ' A' ' 483' ' ' ASP . 16.9 m170 -96.58 152.47 18.61 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 7.9 mp -122.34 -63.99 1.24 Allowed 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 64.0 mtt -95.21 -57.39 2.43 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -171.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -67.77 -12.7 61.11 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.409 ' HB2' ' CB ' ' A' ' 479' ' ' HIS . 26.2 t70 -75.07 8.36 2.64 Favored 'General case' 0 C--O 1.184 -2.379 0 C-N-CA 124.572 1.149 . . . . 0.0 113.13 -175.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -46.72 -61.81 1.67 Allowed 'General case' 0 C--O 1.275 2.395 0 C-N-CA 124.113 0.965 . . . . 0.0 112.682 -174.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -62.84 -43.14 99.59 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.631 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 28.1 m -60.81 -41.79 96.37 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.468 -177.105 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . 0.503 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 39.0 t80 -59.7 -47.12 86.9 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 123.061 0.544 . . . . 0.0 109.843 175.368 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 70.9 mt -66.04 -34.55 78.34 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.463 0.649 . . . . 0.0 110.533 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -67.15 -49.11 65.94 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.711 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . 0.481 ' CZ ' ' HE1' ' A' ' 559' ' ' TYR . 1.3 m-85 -76.96 -8.64 57.74 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . 0.503 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.4 OUTLIER -74.55 -52.39 12.0 Favored 'General case' 0 C--N 1.286 -2.185 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.689 176.348 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.17 -27.86 38.9 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -174.486 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 19.7 p -81.67 -24.42 36.29 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -176.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 50.6 t -96.68 156.24 3.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.086 0.47 . . . . 0.0 110.445 -175.653 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -85.91 124.44 32.38 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -176.78 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.553 ' HA ' ' OG1' ' A' ' 500' ' ' THR . 62.3 pttt -88.75 -15.82 33.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.13 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -69.6 -70.93 0.25 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -175.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -106.9 -31.74 8.21 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.502 -174.005 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -72.66 -37.35 67.97 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.67 -175.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 500' ' ' THR . . . . . 0.553 ' OG1' ' HA ' ' A' ' 496' ' ' LYS . 76.1 m -71.66 102.45 2.78 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.887 0.851 . . . . 0.0 112.496 -179.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -77.13 163.16 26.85 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.32 -1.309 . . . . 0.0 107.773 174.418 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -53.97 -34.84 60.89 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.966 0.803 . . . . 0.0 110.566 179.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -57.15 -56.11 25.97 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.981 175.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -66.13 -30.53 71.04 Favored 'General case' 0 CA--C 1.556 1.195 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.736 -178.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -67.3 -47.71 69.77 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 124.12 0.968 . . . . 0.0 110.072 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.565 ' O ' HG22 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -59.74 -45.91 90.75 Favored 'General case' 0 N--CA 1.425 -1.694 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.869 -178.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 11.8 p -68.28 -40.96 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 O-C-N 123.428 0.455 . . . . 0.0 111.049 -176.664 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -51.28 -53.92 31.0 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.079 0.466 . . . . 0.0 110.558 173.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.37 -41.85 98.95 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.992 -1.004 . . . . 0.0 113.521 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.565 HG22 ' O ' ' A' ' 506' ' ' TYR . 95.7 t -57.55 -52.45 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 CA-C-O 120.889 0.376 . . . . 0.0 110.814 176.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.478 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 10.2 mp -66.37 -38.69 88.13 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.949 -177.694 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -62.99 -49.2 75.61 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.629 0.58 . . . . 0.0 109.555 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -52.64 -51.29 60.73 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.677 0.791 . . . . 0.0 110.75 -179.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -64.11 -53.36 50.87 Favored 'General case' 0 C--O 1.187 -2.223 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.747 177.416 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . 0.478 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 3.6 t80 -52.0 -35.7 47.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.976 0.91 . . . . 0.0 110.968 -177.006 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.41 -25.26 62.26 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -117.28 -38.2 3.39 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.778 0.799 . . . . 0.0 111.951 -177.572 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -124.82 -153.09 0.54 Allowed 'General case' 0 C--N 1.285 -2.233 0 C-N-CA 124.802 1.241 . . . . 0.0 109.16 -171.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -85.2 -162.01 0.66 Allowed 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -82.36 -169.74 2.58 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -177.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -45.43 130.78 8.52 Favored 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 125.48 1.512 . . . . 0.0 114.266 -174.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -118.14 134.41 55.03 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 178.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 1.7 tt -53.72 -26.26 13.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 125.441 1.496 . . . . 0.0 112.029 179.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 48.1 t -54.34 -38.61 66.23 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 122.749 0.42 . . . . 0.0 111.548 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . 0.522 ' O ' ' HB3' ' A' ' 528' ' ' GLN . 2.8 t70 -72.04 -36.91 69.77 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.752 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -58.13 -55.53 33.77 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.132 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.439 ' O ' HG13 ' A' ' 530' ' ' VAL . 14.7 p -66.98 -18.84 24.84 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 CA-C-O 121.498 0.666 . . . . 0.0 111.423 179.296 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . 0.522 ' HB3' ' O ' ' A' ' 525' ' ' ASP . 48.1 tt0 -65.8 -37.75 87.1 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 171.796 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.487 ' C ' ' H ' ' A' ' 531' ' ' ASN . 76.8 m-85 -79.8 9.48 5.16 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 176.982 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.439 HG13 ' O ' ' A' ' 527' ' ' VAL . 5.3 p -74.3 16.84 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 CA-C-O 122.413 1.102 . . . . 0.0 110.794 178.519 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . 0.487 ' H ' ' C ' ' A' ' 529' ' ' TYR . 91.2 m-20 -111.03 -29.57 7.84 Favored 'General case' 0 C--N 1.288 -2.079 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.021 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 12.9 m -81.2 158.52 24.86 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.696 -177.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . 0.475 ' O ' ' HG3' ' A' ' 537' ' ' GLU . 7.8 t30 -65.97 -73.55 0.13 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -177.839 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -71.93 -32.33 67.23 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -172.07 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -66.08 -38.53 88.52 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -178.314 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 11.6 ttm180 -64.4 -56.41 14.48 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 175.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . 0.475 ' HG3' ' O ' ' A' ' 533' ' ' ASN . 42.4 mt-10 -55.83 -70.19 0.12 Allowed 'General case' 0 C--N 1.347 0.468 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.186 -177.771 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 8.9 m -64.31 -54.56 31.15 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -172.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 48.8 tp -63.99 -44.27 93.18 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.013 -173.069 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . 0.586 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 64.8 mt -69.27 -28.23 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.728 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 541' ' ' SER . . . . . 0.447 ' HB2' ' O ' ' A' ' 537' ' ' GLU . 9.0 t -57.43 -44.32 84.57 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 174.184 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.474 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 3.1 mm? -67.47 -23.53 65.51 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 176.183 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . 0.473 ' C ' ' H ' ' A' ' 545' ' ' TYR . 36.6 tt0 -76.63 -26.61 55.1 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 121.349 0.595 . . . . 0.0 109.773 174.628 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . 0.586 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 86.2 mt-30 -80.87 31.86 0.31 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 124.11 0.964 . . . . 0.0 110.368 177.268 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . 0.474 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 6.3 p90 -68.09 166.92 15.04 Favored 'General case' 0 N--CA 1.394 -3.27 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.792 -175.559 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -79.22 156.0 28.35 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 121.688 0.756 . . . . 0.0 112.304 -170.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . 0.43 ' C ' ' H ' ' A' ' 549' ' ' ASP . 3.0 mm? -77.23 6.04 7.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.102 -177.863 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -79.39 21.9 0.46 Allowed 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 125.162 1.385 . . . . 0.0 110.072 177.055 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . 0.43 ' H ' ' C ' ' A' ' 547' ' ' LEU . 3.2 p-10 -67.36 0.5 2.85 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -172.506 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -61.96 140.65 95.73 Favored Pre-proline 0 C--N 1.324 -0.528 0 N-CA-C 104.905 -2.257 . . . . 0.0 104.905 170.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -0.64 66.34 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.094 1 C-N-CA 126.555 4.836 . . . . 0.0 115.532 -167.139 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -89.89 19.98 4.47 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 122.921 1.343 . . . . 0.0 109.76 -171.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -71.97 -4.6 29.44 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-N 113.577 -1.647 . . . . 0.0 110.854 177.411 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . 0.606 ' HA ' ' OD2' ' A' ' 557' ' ' ASP . 14.2 m120 -66.56 -23.07 66.16 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.29 172.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.01 -34.06 72.83 Favored 'General case' 0 C--O 1.21 -1.002 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 175.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 57.0 mt -76.45 -39.92 34.07 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.052 0 C-N-CA 124.123 0.969 . . . . 0.0 109.015 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . 0.606 ' OD2' ' HA ' ' A' ' 554' ' ' ASN . 20.1 m-20 -54.82 -54.15 46.02 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-O 121.759 0.79 . . . . 0.0 108.908 174.444 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.21 -50.66 70.62 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 113.538 -1.665 . . . . 0.0 109.564 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.605 ' O ' HG12 ' A' ' 563' ' ' ILE . 52.5 t80 -56.14 -55.07 37.57 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 124.721 1.208 . . . . 0.0 111.304 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 75.6 t -64.97 -37.26 79.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.032 -174.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -61.43 -41.04 96.55 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 176.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . 0.582 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 78.1 t -72.46 -40.47 63.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 C-N-CA 123.859 0.864 . . . . 0.0 113.175 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.605 HG12 ' O ' ' A' ' 559' ' ' TYR . 28.5 mm -89.02 -49.02 14.41 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.906 0 CA-C-O 122.03 0.919 . . . . 0.0 109.519 -170.031 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -77.49 3.5 13.32 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.559 -175.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.582 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 6.0 pt-20 -75.47 -23.18 56.82 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 174.742 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -84.27 7.37 19.44 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.421 178.236 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . 0.434 ' C ' ' H ' ' A' ' 569' ' ' GLU . . . -79.69 63.69 3.97 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 175.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -75.36 36.68 0.12 Allowed 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 126.369 1.868 . . . . 0.0 111.58 -175.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . 0.434 ' H ' ' C ' ' A' ' 567' ' ' GLY . 27.0 mt-10 -82.09 -71.67 0.47 Allowed 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 179.683 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -163.37 156.78 19.24 Favored 'General case' 0 C--O 1.252 1.201 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.106 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 28.2 mm -45.7 -52.51 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 O-C-N 125.056 1.473 . . . . 0.0 110.451 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -68.77 -30.59 69.22 Favored 'General case' 0 N--CA 1.415 -2.219 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -173.566 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 14.8 m -68.69 -42.98 77.04 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . 0.521 ' O ' ' HG ' ' A' ' 578' ' ' LEU . 0.7 OUTLIER -58.76 -49.09 78.93 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 112.983 -1.917 . . . . 0.0 109.296 175.862 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -58.72 -55.43 35.25 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.209 1.004 . . . . 0.0 111.464 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -55.27 -47.07 76.03 Favored 'General case' 0 CA--C 1.498 -1.04 0 O-C-N 123.736 0.648 . . . . 0.0 111.363 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -65.02 -47.56 77.04 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.521 ' HG ' ' O ' ' A' ' 574' ' ' LEU . 91.2 mt -61.04 -62.68 1.68 Allowed 'General case' 0 C--O 1.251 1.178 0 CA-C-O 122.28 1.038 . . . . 0.0 111.004 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -59.74 -56.53 20.62 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 113.663 -1.608 . . . . 0.0 113.128 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . 0.57 ' O ' ' HG2' ' A' ' 583' ' ' ARG . 28.0 mt-10 -74.64 -35.32 62.87 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 -170.974 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -63.38 -45.75 89.66 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.994 -0.682 . . . . 0.0 110.896 177.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 582' ' ' THR . . . . . . . . . . . . . 4.0 m -71.15 -25.68 62.66 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.325 -0.852 . . . . 0.0 113.022 -178.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.57 ' HG2' ' O ' ' A' ' 580' ' ' GLU . 18.5 ptt180 -48.44 -16.79 0.12 Allowed 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -174.25 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 44.1 pt -78.93 34.33 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 CA-C-O 121.757 0.789 . . . . 0.0 110.945 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . 0.466 ' H ' ' C ' ' A' ' 583' ' ' ARG . . . 129.7 56.68 0.1 Allowed Glycine 0 CA--C 1.493 -1.32 0 N-CA-C 108.777 -1.729 . . . . 0.0 108.777 -178.72 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . 0.557 ' C ' ' H ' ' A' ' 588' ' ' GLU . 23.2 t0 -87.45 142.28 27.99 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 122.203 1.002 . . . . 0.0 113.228 -173.21 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 6.7 t -68.38 22.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.545 0 C-N-CA 129.874 3.269 . . . . 0.0 109.591 173.824 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.655 ' O ' ' HB2' ' A' ' 592' ' ' TYR . 9.2 pt-20 -39.8 -10.73 0.01 OUTLIER 'General case' 0 C--O 1.199 -1.594 0 C-N-CA 130.786 3.634 . . . . 0.0 117.596 -166.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 68.0 tp -74.4 -60.88 2.07 Favored 'General case' 0 C--N 1.268 -2.977 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -55.9 -47.95 76.52 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.846 1.258 . . . . 0.0 109.417 173.12 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.493 ' HB3' ' HA ' ' A' ' 588' ' ' GLU . 0.0 OUTLIER -69.13 -27.8 65.89 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.528 -175.44 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.655 ' HB2' ' O ' ' A' ' 588' ' ' GLU . 28.8 t80 -61.52 -44.39 97.15 Favored 'General case' 0 CA--C 1.494 -1.178 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 177.586 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -57.17 -50.19 73.6 Favored 'General case' 0 C--O 1.238 0.461 0 O-C-N 123.888 0.743 . . . . 0.0 110.741 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 32.3 tp -59.38 -48.88 79.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.436 0.636 . . . . 0.0 110.113 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -63.4 -35.57 80.85 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.247 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.68 -41.76 95.83 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 123.747 0.819 . . . . 0.0 109.388 178.27 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 82.9 mt -57.15 -52.15 59.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 CA-C-O 121.661 0.743 . . . . 0.0 109.218 173.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 77.7 t -63.17 -33.25 59.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.39 -178.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . 0.5 ' HA ' ' HD3' ' A' ' 602' ' ' LYS . . . -59.7 -46.44 89.08 Favored 'General case' 0 CA--C 1.502 -0.903 0 CA-C-O 121.239 0.542 . . . . 0.0 110.086 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . 0.47 ' O ' ' HB2' ' A' ' 604' ' ' ARG . 62.5 mttp -68.85 -31.89 71.17 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.567 177.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -68.68 -33.59 74.24 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.014 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.5 ' HD3' ' HA ' ' A' ' 599' ' ' ALA . 8.3 mtpm? -65.94 -62.69 1.36 Allowed 'General case' 0 CA--C 1.49 -1.347 0 CA-C-O 123.102 1.429 . . . . 0.0 108.693 175.308 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -76.32 1.35 16.4 Favored 'General case' 0 N--CA 1.408 -2.552 0 CA-C-N 112.205 -2.271 . . . . 0.0 113.614 -169.742 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . 0.47 ' HB2' ' O ' ' A' ' 600' ' ' LYS . 15.7 ttm180 -67.58 -30.21 69.77 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 175.027 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 71.6 mtm . . . . . 0 N--CA 1.435 -1.213 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.818 179.749 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -78.8 166.04 22.89 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 170.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -125.93 69.48 1.2 Allowed 'General case' 0 CA--C 1.491 -1.304 0 CA-C-O 121.647 0.737 . . . . 0.0 110.28 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 65.6 mt -72.53 124.01 24.33 Favored 'General case' 0 C--N 1.298 -1.661 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.384 178.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 27.3 p -86.84 160.25 18.81 Favored 'General case' 0 C--N 1.292 -1.902 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.994 -177.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -64.11 -29.17 70.31 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.305 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -66.79 -44.43 81.33 Favored 'General case' 0 C--O 1.19 -2.029 0 O-C-N 123.293 0.37 . . . . 0.0 110.32 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.571 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 1.1 tm-20 -62.65 -28.67 70.08 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-O 121.348 0.594 . . . . 0.0 109.639 -178.038 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.564 ' HD3' ' O ' ' A' ' 471' ' ' LYS . 0.9 OUTLIER -71.2 -35.54 71.6 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 175.033 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -60.52 -48.94 79.56 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . 0.555 ' HB3' ' CD2' ' A' ' 504' ' ' PHE . 1.7 mp0 -58.54 -39.93 81.59 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 121.146 0.498 . . . . 0.0 110.722 175.911 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.571 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 93.8 mtt180 -62.23 -35.34 78.61 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.22 176.87 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -66.26 -38.12 87.1 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.651 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . 0.47 ' O ' HD13 ' A' ' 480' ' ' LEU . 1.3 m-85 -65.83 -26.73 67.8 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 174.285 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . 0.413 HD11 ' CD2' ' A' ' 504' ' ' PHE . 95.1 mt -82.66 -17.08 45.83 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 175.324 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -40.95 -65.13 0.46 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -168.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . 0.479 ' HA ' ' SD ' ' A' ' 481' ' ' MET . 5.7 t-80 -147.57 36.68 0.89 Allowed 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.131 -1.028 . . . . 0.0 108.869 -174.046 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.47 HD13 ' O ' ' A' ' 476' ' ' PHE . 84.0 mt -115.89 29.57 7.9 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.222 -174.467 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 481' ' ' MET . . . . . 0.479 ' SD ' ' HA ' ' A' ' 479' ' ' HIS . 2.1 mpp? -76.07 -38.31 57.2 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.759 -176.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -67.82 -48.2 66.89 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-O 121.912 0.863 . . . . 0.0 110.126 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . 0.432 9.0 p-10 -74.51 60.49 0.88 Allowed 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . 0.473 ' HB2' ' CE2' ' A' ' 515' ' ' TYR . 19.5 ptpt -40.83 -30.97 0.14 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.144 2.178 . . . . 0.0 112.858 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -52.17 -50.19 62.3 Favored 'General case' 0 CA--C 1.504 -0.804 0 C-N-CA 124.796 1.238 . . . . 0.0 108.94 176.292 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 31.6 m -64.28 -35.88 82.27 Favored 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 125.324 1.45 . . . . 0.0 111.968 -177.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -59.32 -53.13 61.7 Favored 'General case' 0 C--O 1.258 1.506 0 CA-C-O 121.76 0.79 . . . . 0.0 109.151 177.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . 0.503 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 4.0 mm? -72.2 -25.06 61.52 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.908 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -65.26 -33.15 75.3 Favored 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 122.982 0.176 . . . . 0.0 110.604 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.79 -33.95 40.07 Favored 'General case' 0 N--CA 1.385 -3.679 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -66.47 -27.33 67.72 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 120.1 -0.64 . . . . 0.0 112.4 173.145 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . 0.503 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 14.4 mm-40 -78.51 -28.28 46.25 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.083 0.468 . . . . 0.0 110.967 175.573 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 51.0 m -85.09 -49.54 8.18 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.601 0.715 . . . . 0.0 110.986 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.2 t -135.96 100.23 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.526 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.523 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . 0.443 ' C ' ' H ' ' A' ' 497' ' ' ASP . 6.0 p-10 -95.19 14.91 20.61 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 122.405 1.097 . . . . 0.0 109.171 174.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -84.64 21.76 1.45 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 127.073 2.149 . . . . 0.0 109.42 178.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . 0.443 ' H ' ' C ' ' A' ' 495' ' ' ASP . 9.7 t70 -53.16 -1.44 0.02 OUTLIER 'General case' 0 CA--C 1.563 1.46 0 C-N-CA 128.991 2.916 . . . . 0.0 114.709 -176.933 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -73.88 -0.99 17.69 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 120.686 -1.259 . . . . 0.0 112.033 -175.463 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -83.46 -18.84 37.2 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.897 177.446 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 23.4 p -60.87 158.23 13.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -172.152 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -91.8 167.31 12.25 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.533 175.202 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -59.84 -24.32 64.11 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 118.453 0.57 . . . . 0.0 110.054 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -54.79 -53.65 52.41 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 175.873 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . 0.555 ' CD2' ' HB3' ' A' ' 473' ' ' GLU . 10.6 t80 -64.4 -40.02 94.98 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.415 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -57.67 -47.2 82.97 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 123.943 0.777 . . . . 0.0 109.25 -176.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.595 ' O ' HG22 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -60.77 -45.53 93.99 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.135 -179.176 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 45.9 t -62.8 -48.55 87.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 120.385 -0.526 . . . . 0.0 110.221 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -49.54 -49.78 44.68 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.951 0.782 . . . . 0.0 110.654 174.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -58.22 -55.84 29.74 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.946 -177.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.595 HG22 ' O ' ' A' ' 506' ' ' TYR . 12.1 t -57.69 -52.03 62.64 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.492 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 88.9 mt -56.31 -53.05 61.88 Favored 'General case' 0 C--O 1.213 -0.859 0 O-C-N 123.819 0.699 . . . . 0.0 111.421 -176.434 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -61.64 -38.49 87.87 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.519 0.728 . . . . 0.0 110.588 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -67.49 -52.27 41.22 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.451 -176.515 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . 0.264 5.0 p90 -73.71 -31.11 63.24 Favored 'General case' 0 C--O 1.192 -1.936 0 C-N-CA 119.008 -1.077 . . . . 0.0 111.985 -178.981 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . 0.492 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 0.4 OUTLIER -55.67 -41.54 73.8 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.811 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -67.18 -18.69 65.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.151 -0.932 . . . . 0.0 112.497 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -115.67 -44.8 2.93 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 119.948 -0.701 . . . . 0.0 112.168 -178.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -125.59 -151.79 0.49 Allowed 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 124.852 1.261 . . . . 0.0 111.391 -168.741 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 6.1 p-10 -105.51 -157.49 0.62 Allowed 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 127.047 2.139 . . . . 0.0 110.456 -173.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -60.51 177.68 0.27 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 125.834 1.654 . . . . 0.0 113.876 -170.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -90.29 146.92 23.84 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.87 1.668 . . . . 0.0 109.085 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -118.58 155.33 31.12 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 50.1 pt -64.0 -21.87 29.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 O-C-N 122.249 -0.282 . . . . 0.0 111.567 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 22.7 t -57.66 -34.87 69.82 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -63.71 -50.32 69.65 Favored 'General case' 0 C--N 1.349 0.549 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -59.0 -44.37 91.66 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.594 0.712 . . . . 0.0 110.857 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.506 ' O ' HG22 ' A' ' 530' ' ' VAL . 55.8 t -65.1 -37.46 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.531 0 C-N-CA 124.052 0.941 . . . . 0.0 111.912 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -70.21 -16.85 63.11 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 117.95 -1.5 . . . . 0.0 110.213 175.644 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.419 ' C ' ' H ' ' A' ' 531' ' ' ASN . 51.8 m-85 -80.59 6.42 12.65 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 172.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.506 HG22 ' O ' ' A' ' 527' ' ' VAL . 26.9 m -74.34 10.63 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.514 173.559 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . 0.419 ' H ' ' C ' ' A' ' 529' ' ' TYR . 51.2 m-80 -99.12 -15.02 19.13 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.943 177.24 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 532' ' ' SER . . . . . 0.418 ' HB2' ' HB2' ' A' ' 535' ' ' LEU . 27.1 m -88.69 156.2 19.14 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.776 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -63.18 -75.01 0.08 Allowed 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -86.4 -28.55 23.51 Favored 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 121.399 0.619 . . . . 0.0 110.257 -173.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 532' ' ' SER . 58.3 mt -62.08 -32.95 73.55 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.942 -174.56 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -53.84 -63.43 1.15 Allowed 'General case' 0 C--O 1.255 1.37 0 O-C-N 124.293 0.996 . . . . 0.0 109.675 176.224 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -63.26 -55.72 22.52 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.359 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.403 ' O ' HD12 ' A' ' 542' ' ' LEU . 23.4 m -58.83 -53.81 54.21 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -174.752 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . 0.299 4.0 mm? -63.88 -40.4 96.45 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -176.493 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 58.6 mt -68.85 -34.91 66.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 118.637 -1.225 . . . . 0.0 109.774 176.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 34.6 t -56.76 -48.91 76.76 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.491 ' HA ' ' CE2' ' A' ' 545' ' ' TYR . 6.6 mp -64.7 -32.22 73.8 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 124.671 1.188 . . . . 0.0 112.454 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.59 -54.83 7.26 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . 0.615 ' HG2' ' O ' ' A' ' 544' ' ' GLN . 46.9 tt0 -74.64 35.08 0.1 Allowed 'General case' 0 CA--C 1.564 1.489 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -173.931 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . 0.491 ' CE2' ' HA ' ' A' ' 542' ' ' LEU . 16.6 m-85 -77.28 166.35 23.29 Favored 'General case' 0 C--N 1.265 -3.105 0 O-C-N 120.491 -1.38 . . . . 0.0 110.882 170.498 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -93.5 117.85 30.59 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 92.8 mt -74.43 -16.27 60.88 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.199 -176.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -70.5 -43.07 70.44 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.838 177.391 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . 0.441 ' C ' ' HD3' ' A' ' 551' ' ' PRO . 40.6 m-20 -74.81 1.21 13.1 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.424 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.408 ' N ' ' HD3' ' A' ' 551' ' ' PRO . 35.6 tt0 -119.59 67.99 10.83 Favored Pre-proline 0 CA--C 1.567 1.623 0 C-N-CA 119.262 -0.975 . . . . 0.0 113.039 -175.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . 0.465 ' HD2' ' H ' ' A' ' 552' ' ' TYR . 72.1 Cg_endo -119.25 -14.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.579 2.747 0 C-N-CA 122.24 1.96 . . . . 0.0 114.658 168.44 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . 0.465 ' H ' ' HD2' ' A' ' 551' ' ' PRO . 48.7 m-85 -114.15 52.8 0.81 Allowed 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 124.773 1.229 . . . . 0.0 108.287 -171.206 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . 0.42 ' HA ' ' OE1' ' A' ' 553' ' ' GLU 0.277 7.5 mm-40 -58.84 67.84 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 118.622 2.823 . . . . 0.0 118.622 -170.049 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -65.94 -20.95 66.38 Favored 'General case' 0 C--O 1.194 -1.816 0 CA-C-N 113.649 -1.614 . . . . 0.0 108.992 169.22 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -43.91 -41.01 4.95 Favored 'General case' 0 C--O 1.204 -1.294 0 C-N-CA 124.611 1.164 . . . . 0.0 111.519 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 62.1 mt -64.17 -45.32 96.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 13.7 t70 -60.03 -45.49 92.62 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.256 175.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . 0.503 ' O ' HG23 ' A' ' 562' ' ' VAL . 18.4 t70 -58.16 -56.34 23.34 Favored 'General case' 0 CA--C 1.503 -0.828 0 C-N-CA 124.404 1.082 . . . . 0.0 109.407 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -48.03 -53.16 17.21 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 125.28 1.432 . . . . 0.0 110.138 176.169 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 37.2 t -57.69 -50.94 75.84 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.949 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.772 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.04 -31.41 71.82 Favored 'General case' 0 C--O 1.209 -1.034 0 C-N-CA 123.3 0.64 . . . . 0.0 111.677 -179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 558' ' ' ASP . 78.0 t -69.0 -34.71 65.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 CA-C-O 121.329 0.585 . . . . 0.0 111.776 178.088 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . . . . . . . . . 57.3 mt -87.41 -35.67 8.72 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.248 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . 0.492 ' HA ' ' OE1' ' A' ' 572' ' ' GLU . 4.1 t-20 -77.62 2.57 16.22 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 113.694 -1.594 . . . . 0.0 109.83 176.52 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.32 -31.09 67.01 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 174.838 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -76.81 5.77 7.21 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -174.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . 162.51 145.39 4.32 Favored Glycine 1 N--CA 1.393 -4.226 0 C-N-CA 119.422 -1.37 . . . . 0.0 111.487 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -138.59 47.53 1.96 Allowed 'General case' 0 C--N 1.262 -3.205 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 170.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . 0.537 ' CD ' ' H ' ' A' ' 570' ' ' THR . 0.0 OUTLIER -99.4 -98.28 0.23 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -175.037 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 570' ' ' THR . . . . . 0.537 ' H ' ' CD ' ' A' ' 569' ' ' GLU . 15.4 m -108.3 -55.32 2.39 Favored 'General case' 0 N--CA 1.421 -1.906 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 23.2 mt -62.26 -49.64 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.706 0 CA-C-O 121.977 0.894 . . . . 0.0 109.385 -173.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . 0.568 ' O ' ' HB3' ' A' ' 575' ' ' ASN . 60.2 mm-40 -67.3 -19.15 65.43 Favored 'General case' 0 N--CA 1.404 -2.774 0 CA-C-N 113.862 -1.517 . . . . 0.0 112.723 -176.225 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 48.8 m -71.28 -38.69 71.81 Favored 'General case' 0 C--O 1.269 2.087 0 O-C-N 121.925 -0.484 . . . . 0.0 110.049 173.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . 0.623 ' HA ' ' HE2' ' A' ' 602' ' ' LYS . 7.2 mp -62.11 -38.84 90.44 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 123.267 1.508 . . . . 0.0 109.419 177.071 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . 0.614 ' O ' ' HB3' ' A' ' 578' ' ' LEU 0.263 10.2 t30 -60.54 -27.57 67.76 Favored 'General case' 1 C--N 1.235 -4.403 0 CA-C-N 111.781 -2.463 . . . . 0.0 112.016 175.124 . . . . . . . . 4 3 . 1 . 013 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -69.81 -34.5 73.79 Favored 'General case' 0 C--N 1.314 -0.952 0 O-C-N 120.788 -1.195 . . . . 0.0 111.266 171.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . 0.493 ' HB3' ' O ' ' A' ' 574' ' ' LEU . 50.0 tptt -60.03 -39.21 85.11 Favored 'General case' 0 CA--C 1.561 1.375 0 CA-C-O 121.9 0.857 . . . . 0.0 109.502 170.439 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.614 ' HB3' ' O ' ' A' ' 575' ' ' ASN . 63.6 tp -55.12 -37.48 66.96 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.591 171.423 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.436 ' HA ' ' OG1' ' A' ' 582' ' ' THR . 8.5 tpt180 -62.68 -32.4 73.47 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-O 121.75 0.786 . . . . 0.0 110.245 175.533 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . 0.463 ' HG3' ' NE2' ' A' ' 595' ' ' GLN . 26.2 tt0 -62.72 -35.63 80.37 Favored 'General case' 0 C--O 1.2 -1.527 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 175.535 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -66.97 -25.97 66.58 Favored 'General case' 0 CA--C 1.569 1.69 0 CA-C-O 121.468 0.651 . . . . 0.0 111.752 171.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.493 ' C ' ' H ' ' A' ' 584' ' ' ILE . 14.6 m -66.7 -23.27 66.1 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 126.311 1.845 . . . . 0.0 111.888 176.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . . . . . . . . . 14.6 ptp180 -33.33 13.56 0.0 OUTLIER 'General case' 0 N--CA 1.536 3.826 0 N-CA-C 118.13 2.641 . . . . 0.0 118.13 173.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . 0.493 ' H ' ' C ' ' A' ' 582' ' ' THR . 33.4 pt -81.78 12.28 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.408 0 C-N-CA 124.675 1.19 . . . . 0.0 110.152 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 132.73 57.77 0.08 OUTLIER Glycine 0 CA--C 1.5 -0.892 0 C-N-CA 119.255 -1.45 . . . . 0.0 115.613 171.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . 0.467 ' O ' ' HG3' ' A' ' 591' ' ' LYS . 22.0 p-10 -142.22 58.99 1.47 Allowed 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 104.445 -2.428 . . . . 0.0 104.445 173.27 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . 0.376 8.1 p -64.75 -87.89 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.874 0 N-CA-C 121.117 3.747 . . . . 0.0 121.117 -162.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.553 ' CD ' ' H ' ' A' ' 589' ' ' LEU 0.374 0.0 OUTLIER -65.83 -88.22 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 117.594 2.442 . . . . 0.0 117.594 -158.478 . . . . . . . . 4 4 . 1 . 013 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . 0.553 ' H ' ' CD ' ' A' ' 588' ' ' GLU . 7.2 tt -71.8 -33.23 68.37 Favored 'General case' 0 C--N 1.282 -2.367 0 C-N-CA 124.482 1.113 . . . . 0.0 108.388 -175.261 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -54.75 -54.09 46.58 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 113.585 -1.643 . . . . 0.0 110.99 -177.302 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.503 ' O ' ' HB3' ' A' ' 595' ' ' GLN . 50.6 mtmt -84.99 -38.24 19.48 Favored 'General case' 0 C--O 1.199 -1.56 0 CA-C-O 118.619 -0.705 . . . . 0.0 112.631 179.255 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -50.1 -54.74 18.45 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.366 0.416 . . . . 0.0 110.902 -174.063 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . 0.612 ' O ' HD11 ' A' ' 597' ' ' ILE . 55.7 m-85 -64.99 -60.5 2.97 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 177.21 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 2.8 tp -59.65 -53.15 61.33 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 122.63 1.205 . . . . 0.0 110.624 -170.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . 0.503 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 18.9 tt0 -71.93 -64.37 0.95 Allowed 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 113.684 -1.598 . . . . 0.0 112.414 -174.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -60.8 -39.66 89.76 Favored 'General case' 0 C--O 1.246 0.92 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.401 -167.807 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . 0.612 HD11 ' O ' ' A' ' 593' ' ' TYR . 1.7 mp -61.39 -56.54 17.16 Favored 'Isoleucine or valine' 0 C--O 1.252 1.198 0 O-C-N 123.671 0.607 . . . . 0.0 110.843 176.272 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 23.6 t -78.53 -30.45 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 C-N-CA 118.842 -1.143 . . . . 0.0 113.095 -172.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . 0.424 ' O ' ' HB3' ' A' ' 602' ' ' LYS . . . -63.23 -40.85 98.62 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 122.637 0.375 . . . . 0.0 110.766 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -66.69 -40.77 88.66 Favored 'General case' 0 N--CA 1.439 -1.017 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.29 176.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . 0.561 ' O ' ' HG2' ' A' ' 605' ' ' MET . 66.8 t30 -66.81 -30.68 70.93 Favored 'General case' 0 C--O 1.213 -0.819 0 CA-C-O 120.81 0.338 . . . . 0.0 110.848 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.623 ' HE2' ' HA ' ' A' ' 574' ' ' LEU . 31.7 tttm -60.19 -51.96 67.37 Favored 'General case' 0 CA--C 1.5 -0.976 0 C-N-CA 124.134 0.974 . . . . 0.0 108.909 178.166 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -68.96 -39.17 79.64 Favored 'General case' 0 N--CA 1.417 -2.078 0 CA-C-N 113.913 -1.494 . . . . 0.0 109.712 -177.452 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -78.31 14.04 1.34 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 605' ' ' MET . . . . . 0.561 ' HG2' ' O ' ' A' ' 601' ' ' ASN . 85.0 mmm . . . . . 0 CA--C 1.502 -0.883 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 N--CA 1.441 -0.879 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -80.44 119.15 22.75 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -90.38 50.33 1.82 Allowed 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.503 1.144 . . . . 0.0 109.099 -173.705 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.47 125.04 22.18 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-N 114.0 -1.455 . . . . 0.0 110.616 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 15.0 m -95.16 150.34 20.31 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.891 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' A' ' 471' ' ' LYS . 19.9 tpp180 -60.98 -20.38 62.32 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.621 1.169 . . . . 0.0 110.712 -178.771 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.631 HE21 ' N ' ' A' ' 469' ' ' GLN . 0.0 OUTLIER -58.99 -40.57 85.25 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.642 177.971 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.579 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 34.2 tt0 -67.03 -30.81 71.0 Favored 'General case' 0 C--O 1.203 -1.345 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 468' ' ' ARG . 27.1 tptp -62.48 -37.93 87.88 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.904 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -64.44 -45.43 87.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.559 0.695 . . . . 0.0 109.239 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.94 -33.46 74.31 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.745 177.542 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.579 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 98.9 mtt180 -65.92 -36.8 84.37 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 122.459 0.304 . . . . 0.0 110.524 175.118 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -65.9 -45.5 81.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.307 0.575 . . . . 0.0 109.954 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.28 -27.78 68.71 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 122.031 0.919 . . . . 0.0 111.173 175.821 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . 0.478 ' HB3' ' O ' ' A' ' 474' ' ' ARG . 61.8 tp -77.22 -14.83 59.7 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 126.004 1.722 . . . . 0.0 113.557 -175.314 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -41.12 -50.26 3.46 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.312 1.045 . . . . 0.0 110.833 -173.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -168.2 128.23 1.28 Allowed 'General case' 0 CA--C 1.48 -1.73 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 166.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.498 ' HG ' ' OD2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -58.48 119.49 7.09 Favored 'General case' 0 C--O 1.251 1.145 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 -179.599 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 72.8 mtm -93.21 -53.57 4.05 Favored 'General case' 0 N--CA 1.424 -1.759 0 N-CA-C 115.343 1.608 . . . . 0.0 115.343 -172.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . 0.636 ' HB2' ' OG1' ' A' ' 486' ' ' THR 0.255 36.4 mmt180 -76.33 -99.05 0.02 OUTLIER 'General case' 0 C--O 1.212 -0.875 0 C-N-CA 116.379 -2.129 . . . . 0.0 114.409 -174.263 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.637 ' OD2' ' HG3' ' A' ' 484' ' ' LYS . 25.4 t70 -145.72 -86.89 0.11 Allowed 'General case' 0 C--O 1.196 -1.726 0 C-N-CA 115.639 -2.424 . . . . 0.0 116.819 170.157 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . 0.637 ' HG3' ' OD2' ' A' ' 483' ' ' ASP . 61.8 mttp -97.54 -52.33 3.82 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.669 -1.15 . . . . 0.0 113.464 -178.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -56.45 -42.75 78.69 Favored 'General case' 0 CA--C 1.497 -1.085 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.88 -178.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.636 ' OG1' ' HB2' ' A' ' 482' ' ' ARG . 42.2 m -61.51 -37.57 84.2 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.975 -177.705 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -62.62 -54.12 44.32 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.658 177.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . 0.476 HD11 ' HH ' ' A' ' 515' ' ' TYR . 77.5 mt -66.8 -28.46 68.4 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.172 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -61.49 -40.97 96.5 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 123.765 0.826 . . . . 0.0 110.659 -179.18 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -92.51 -37.15 12.67 Favored 'General case' 0 N--CA 1.399 -3.02 0 C-N-CA 120.486 -0.485 . . . . 0.0 110.732 178.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -79.95 -59.65 2.64 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -175.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -78.82 -7.4 57.83 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.839 0.828 . . . . 0.0 111.751 -166.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 18.2 m -75.51 -6.8 52.04 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.469 177.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 46.0 t -100.27 99.22 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -97.45 -82.84 0.41 Allowed 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.424 ' C ' ' H ' ' A' ' 498' ' ' ASN . 29.3 mmmt -83.17 -26.88 30.49 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.575 0.702 . . . . 0.0 110.876 -179.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . 0.48 ' C ' ' H ' ' A' ' 499' ' ' PHE . 38.0 t70 -77.56 31.09 0.15 Allowed 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 125.574 1.55 . . . . 0.0 110.914 -178.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . 0.424 ' H ' ' C ' ' A' ' 496' ' ' LYS . 3.9 p-10 -72.93 33.53 0.07 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.688 1.195 . . . . 0.0 111.78 -177.731 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . 0.48 ' H ' ' C ' ' A' ' 497' ' ' ASP . 15.1 p90 -73.52 -13.81 61.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.055 -179.719 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.84 150.78 31.78 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -74.72 163.81 27.28 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 114.801 -1.091 . . . . 0.0 112.052 -172.158 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . 0.466 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 8.7 tt0 -56.18 -5.22 0.17 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.438 1.895 . . . . 0.0 111.839 177.723 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -52.6 -45.17 66.43 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 172.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.84 -30.31 70.03 Favored 'General case' 0 C--O 1.204 -1.301 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.646 175.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . 0.466 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 22.1 tptm -70.35 -47.75 59.54 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.241 0.617 . . . . 0.0 110.332 -175.415 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.51 ' O ' HG22 ' A' ' 510' ' ' VAL . 96.9 m-85 -59.63 -46.8 87.92 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . 0.425 ' CG2' HD11 ' A' ' 477' ' ' LEU . 71.1 t -58.25 -57.49 10.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 114.227 -1.351 . . . . 0.0 111.263 178.134 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -48.41 -45.59 36.32 Favored 'General case' 0 C--O 1.212 -0.885 0 O-C-N 124.047 0.842 . . . . 0.0 112.349 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.3 -53.77 52.46 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.048 0.452 . . . . 0.0 110.491 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 506' ' ' TYR . 24.5 t -60.85 -51.35 74.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 CA-C-O 121.368 0.604 . . . . 0.0 111.097 -178.63 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 10.4 mp -66.91 -34.05 76.92 Favored 'General case' 0 C--O 1.2 -1.546 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.482 -175.707 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -65.85 -29.53 70.0 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 120.99 0.424 . . . . 0.0 110.548 176.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.12 -37.05 80.7 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.359 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 28.9 m-85 -76.46 -46.16 28.1 Favored 'General case' 0 C--O 1.2 -1.551 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.324 178.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . 0.476 ' HH ' HD11 ' A' ' 488' ' ' LEU . 42.7 t80 -46.21 -32.83 3.24 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.901 1.68 . . . . 0.0 111.129 176.419 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -57.55 -29.8 64.69 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.783 178.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . 0.415 ' HG3' HD21 ' A' ' 518' ' ' ASN . 11.5 tp10 -119.77 -59.73 1.78 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.016 175.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . 0.415 HD21 ' HG3' ' A' ' 517' ' ' GLU . 6.5 p30 -158.31 124.32 4.61 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 176.109 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . 0.498 ' OD2' ' HG ' ' A' ' 480' ' ' LEU . 24.3 t0 -95.4 96.75 9.32 Favored 'General case' 0 CA--C 1.484 -1.572 0 C-N-CA 117.274 -1.77 . . . . 0.0 110.468 179.616 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . 0.46 ' HG2' ' O ' ' A' ' 482' ' ' ARG . 88.5 mt-30 -137.86 77.1 1.61 Allowed 'General case' 0 C--N 1.274 -2.7 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 178.196 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -46.53 121.05 3.21 Favored 'General case' 0 N--CA 1.427 -1.588 0 C-N-CA 126.093 1.757 . . . . 0.0 113.039 -174.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -91.02 167.13 12.61 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.602 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 44.7 pt -87.07 -17.37 8.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 C-N-CA 120.166 -0.614 . . . . 0.0 112.132 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 23.0 t -60.16 -46.17 90.6 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.19 -38.04 87.6 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.676 176.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -60.37 -48.03 83.53 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 120.998 0.428 . . . . 0.0 110.409 176.422 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.504 ' O ' HG21 ' A' ' 530' ' ' VAL . 97.5 t -64.98 -30.71 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 C-N-CA 123.719 0.807 . . . . 0.0 111.018 177.363 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -65.1 -32.55 74.31 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.416 -0.802 . . . . 0.0 109.159 172.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -77.71 10.78 2.47 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 176.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.504 HG21 ' O ' ' A' ' 527' ' ' VAL . 22.1 m -75.26 6.79 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 118.313 -1.355 . . . . 0.0 111.264 171.412 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -93.59 -8.06 42.28 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.079 175.748 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 20.1 m -85.66 154.76 21.45 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 176.009 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -71.71 -73.11 0.19 Allowed 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 178.535 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -81.22 -36.8 29.58 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.837 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 43.9 tp -65.16 -34.6 78.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.865 -177.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 38.2 ttp180 -57.89 -54.53 45.88 Favored 'General case' 0 C--O 1.254 1.315 0 CA-C-O 121.718 0.77 . . . . 0.0 109.344 176.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -53.42 -70.34 0.09 Allowed 'General case' 0 N--CA 1.425 -1.696 0 CA-C-N 113.369 -1.741 . . . . 0.0 110.669 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.426 ' O ' HD11 ' A' ' 542' ' ' LEU 0.291 6.4 p -64.4 -52.69 56.91 Favored 'General case' 0 N--CA 1.425 -1.688 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -173.18 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 51.8 tp -59.03 -44.43 91.74 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -174.685 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 1.8 mp -75.04 -38.87 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 119.551 -0.86 . . . . 0.0 109.43 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 30.1 t -55.41 -45.6 76.71 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.484 175.717 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.521 ' O ' ' HB2' ' A' ' 545' ' ' TYR . 5.2 mp -64.95 -37.53 87.96 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.063 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . 0.512 ' C ' ' H ' ' A' ' 545' ' ' TYR . 13.1 tp10 -64.99 -33.62 76.49 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.884 0.373 . . . . 0.0 110.886 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -76.43 40.9 0.23 Allowed 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 123.048 1.404 . . . . 0.0 110.67 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . 0.521 ' HB2' ' O ' ' A' ' 542' ' ' LEU . 2.8 t80 -72.09 -172.69 0.92 Allowed 'General case' 0 C--N 1.283 -2.294 0 C-N-CA 128.658 2.783 . . . . 0.0 110.658 -176.898 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . 0.486 ' HB2' ' OD1' ' A' ' 548' ' ' ASN . 1.6 m-80 -85.98 172.08 10.94 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -80.02 14.19 1.94 Allowed 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.158 0.504 . . . . 0.0 111.689 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . 0.486 ' OD1' ' HB2' ' A' ' 546' ' ' ASN . 3.6 p-10 -75.94 -2.03 28.39 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 123.901 0.88 . . . . 0.0 112.472 -176.625 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -69.75 33.34 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.362 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.428 ' H ' ' C ' ' A' ' 548' ' ' ASN . 46.2 mt-10 -103.15 -176.99 0.48 Allowed Pre-proline 0 C--N 1.305 -1.336 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 172.645 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . 0.403 ' CD ' ' HB3' ' A' ' 550' ' ' GLU . 33.7 Cg_exo -62.97 61.95 0.16 Allowed 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.433 2.089 . . . . 0.0 113.807 176.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -135.22 37.73 2.97 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 105.839 -1.911 . . . . 0.0 105.839 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -67.9 67.12 0.1 Allowed 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -171.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -71.3 -21.45 62.07 Favored 'General case' 0 CA--C 1.491 -1.31 0 C-N-CA 125.279 1.432 . . . . 0.0 108.573 172.452 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -45.17 -45.31 11.46 Favored 'General case' 0 C--O 1.207 -1.174 0 C-N-CA 124.63 1.172 . . . . 0.0 109.222 171.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 53.9 mt -67.4 -44.21 87.13 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.447 0 O-C-N 123.649 0.593 . . . . 0.0 109.483 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -59.14 -47.34 85.64 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 120.97 0.415 . . . . 0.0 111.152 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.83 -42.47 81.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.073 0.549 . . . . 0.0 110.286 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.563 ' O ' HG12 ' A' ' 563' ' ' ILE . 93.4 t80 -53.6 -51.57 62.6 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.809 1.244 . . . . 0.0 108.763 173.504 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 9.6 t -55.07 -52.19 46.75 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.751 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.483 175.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -55.57 -38.01 68.78 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.34 0.656 . . . . 0.0 111.441 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 62.9 t -73.6 -32.93 37.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 177.927 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.563 HG12 ' O ' ' A' ' 559' ' ' TYR . 42.0 mm -90.59 -33.87 6.15 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.956 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -174.348 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -86.61 14.64 6.6 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 113.783 -1.553 . . . . 0.0 108.14 176.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -70.85 -19.76 62.61 Favored 'General case' 0 C--N 1.347 0.459 0 N-CA-C 105.494 -2.039 . . . . 0.0 105.494 169.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . 0.411 ' HE2' ' OE1' ' A' ' 469' ' ' GLN . 74.3 mmtt -77.12 -4.85 46.55 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 113.783 -1.553 . . . . 0.0 109.571 173.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -84.24 85.88 1.54 Allowed Glycine 0 CA--C 1.47 -2.74 0 CA-C-O 122.466 1.037 . . . . 0.0 113.091 -171.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -99.91 -62.98 1.17 Allowed 'General case' 0 C--N 1.266 -3.034 0 CA-C-N 113.115 -1.542 . . . . 0.0 107.442 173.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -131.77 171.38 13.58 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.68 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.6 m 70.55 -68.13 0.22 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 170.011 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 33.8 pt -70.94 -6.0 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.593 0 CA-C-O 121.512 0.672 . . . . 0.0 111.515 -177.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -69.58 -15.26 63.18 Favored 'General case' 0 N--CA 1.405 -2.72 0 CA-C-O 121.748 0.785 . . . . 0.0 110.69 175.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 22.9 t -69.22 -46.78 66.53 Favored 'General case' 0 N--CA 1.415 -2.223 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 169.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . 0.541 ' O ' ' HG ' ' A' ' 578' ' ' LEU 0.276 3.7 pp -67.6 -22.36 65.37 Favored 'General case' 0 C--O 1.204 -1.332 0 C-N-CA 120.324 -0.55 . . . . 0.0 112.151 178.144 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 43.8 t-20 -55.91 -44.38 78.22 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -59.14 -44.96 92.08 Favored 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.463 174.261 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -62.62 -37.36 86.01 Favored 'General case' 0 C--O 1.205 -1.248 0 CA-C-N 114.728 -1.123 . . . . 0.0 112.015 -178.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.541 ' HG ' ' O ' ' A' ' 574' ' ' LEU . 91.0 mt -58.13 -39.64 79.24 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 123.196 0.598 . . . . 0.0 110.753 176.783 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.548 ' HA ' ' NE ' ' A' ' 579' ' ' ARG . 4.8 mmp_? -60.26 -43.83 95.81 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.696 0.76 . . . . 0.0 110.792 175.468 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . 0.594 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 40.2 mt-10 -69.05 -34.08 74.62 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.98 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -62.08 -49.31 76.44 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 123.595 0.758 . . . . 0.0 111.932 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.656 ' O ' ' HB2' ' A' ' 586' ' ' ASP . 30.7 p -68.41 -27.72 66.45 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 122.135 0.174 . . . . 0.0 110.865 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.594 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 38.4 ttt180 -49.57 -7.47 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 126.799 2.04 . . . . 0.0 114.051 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 18.1 tt -81.81 31.65 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.593 2.602 0 CA-C-O 122.633 1.206 . . . . 0.0 109.476 175.611 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . 0.413 ' H ' ' C ' ' A' ' 583' ' ' ARG . . . 129.32 56.43 0.1 Allowed Glycine 0 C--N 1.331 0.305 0 N-CA-C 110.477 -1.049 . . . . 0.0 110.477 178.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . 0.656 ' HB2' ' O ' ' A' ' 582' ' ' THR . 39.5 t0 -124.26 164.11 20.24 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.353 0.597 . . . . 0.0 112.3 -171.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 2.2 t -67.43 22.98 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.578 2.051 0 C-N-CA 129.239 3.016 . . . . 0.0 109.018 171.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.594 ' H ' ' C ' ' A' ' 586' ' ' ASP . 32.9 tt0 -32.43 -40.28 0.05 OUTLIER 'General case' 0 C--O 1.198 -1.632 0 C-N-CA 130.639 3.576 . . . . 0.0 114.075 -168.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.06 -49.37 65.32 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 122.49 0.316 . . . . 0.0 111.05 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -58.61 -45.1 89.87 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 122.278 1.037 . . . . 0.0 109.752 175.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.446 ' HD2' ' OD2' ' A' ' 586' ' ' ASP . 95.7 mttt -77.9 -25.8 48.68 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.669 -1.151 . . . . 0.0 112.581 -175.122 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -61.5 -43.52 98.72 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 173.702 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . 0.679 ' O ' HG12 ' A' ' 597' ' ' ILE . 79.2 t80 -60.22 -49.74 76.43 Favored 'General case' 0 C--O 1.203 -1.342 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.266 176.386 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 26.9 tp -54.31 -46.09 72.75 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 121.909 0.861 . . . . 0.0 110.906 177.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -60.96 -50.66 72.49 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.697 -177.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -63.49 -32.58 74.08 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.522 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . 0.679 HG12 ' O ' ' A' ' 593' ' ' TYR . 41.8 mm -55.89 -65.4 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 9.8 p -68.83 -36.73 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.566 -171.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -65.51 -48.95 70.81 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.709 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -68.3 -19.78 64.71 Favored 'General case' 0 C--O 1.21 -1.019 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.941 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -65.48 -43.68 89.46 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 116.313 -0.403 . . . . 0.0 109.994 175.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . . . . . . . . 0.281 46.5 mmtt -67.81 -56.18 10.17 Favored 'General case' 0 CA--C 1.486 -1.512 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 177.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -78.39 14.38 1.25 Allowed 'General case' 0 N--CA 1.401 -2.881 0 CA-C-N 110.937 -2.847 . . . . 0.0 112.857 -169.195 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? -61.24 -48.97 79.03 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 171.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 15.0 tpt . . . . . 0 C--N 1.308 -1.213 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.715 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 14.6 p90 . . . . . 0 N--CA 1.435 -1.202 0 CA-C-O 121.755 0.788 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -105.82 127.55 53.17 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 175.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -133.98 57.01 1.82 Allowed 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 175.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.73 144.68 56.84 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.077 -177.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 20.0 m -99.5 133.66 43.5 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.255 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 36.5 ttm105 -60.01 -23.61 63.81 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.489 1.138 . . . . 0.0 109.255 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.559 ' O ' ' HG2' ' A' ' 473' ' ' GLU . 82.4 mt-30 -54.45 -38.14 66.01 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 126.4 1.88 . . . . 0.0 113.308 -177.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 1.8 tm-20 -68.45 -39.16 81.58 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.337 0.589 . . . . 0.0 109.629 -175.661 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -67.73 -33.5 74.99 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.992 175.679 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -70.19 -39.98 74.91 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.703 178.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . 0.559 ' HG2' ' O ' ' A' ' 469' ' ' GLN . 6.6 mm-40 -60.88 -39.75 90.39 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.099 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 95.4 mtt180 -59.49 -47.2 86.43 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.898 176.566 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -65.36 -35.42 80.91 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.054 -178.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.63 -57.63 12.15 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.906 0.754 . . . . 0.0 109.42 179.165 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 27.3 mt -67.74 -31.61 71.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.553 -175.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . 0.281 23.3 mmmt -102.54 -5.86 23.49 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 116.917 2.191 . . . . 0.0 116.917 -175.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 24.7 m170 -99.4 -22.32 15.59 Favored 'General case' 0 CA--C 1.488 -1.437 0 C-N-CA 119.21 -0.996 . . . . 0.0 110.848 173.204 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 48.6 tp -115.98 102.26 9.5 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 24.0 mmt -67.49 -26.36 66.32 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 122.394 1.093 . . . . 0.0 108.253 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . 0.621 ' HA ' ' NE2' ' A' ' 520' ' ' GLN . 3.4 mpt_? -69.14 -7.1 33.04 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 113.707 -1.588 . . . . 0.0 113.858 176.737 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.46 ' CG ' ' HB ' ' A' ' 486' ' ' THR . 3.4 t70 -71.4 56.8 0.25 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 122.517 1.151 . . . . 0.0 111.889 -176.751 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . 0.509 ' O ' ' HB3' ' A' ' 487' ' ' PHE . 82.3 tttt -93.77 -63.87 1.15 Allowed 'General case' 0 C--O 1.268 2.066 0 CA-C-O 123.066 1.412 . . . . 0.0 107.84 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -60.92 -46.18 91.68 Favored 'General case' 0 CA--C 1.491 -1.307 0 CA-C-N 113.546 -1.661 . . . . 0.0 108.059 175.424 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.46 ' HB ' ' CG ' ' A' ' 483' ' ' ASP . 1.3 m -62.16 -35.7 79.6 Favored 'General case' 0 C--O 1.189 -2.127 0 CA-C-N 114.251 -1.34 . . . . 0.0 110.957 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . 0.509 ' HB3' ' O ' ' A' ' 484' ' ' LYS . 7.4 t80 -51.35 -56.37 13.47 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.132 0.492 . . . . 0.0 110.708 174.436 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.58 -27.47 62.21 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 118.541 -1.264 . . . . 0.0 110.667 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -75.18 -32.22 61.19 Favored 'General case' 0 C--O 1.211 -0.964 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . 0.435 ' HD1' ' O ' ' A' ' 487' ' ' PHE . 0.0 OUTLIER -73.53 -37.68 65.53 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 -178.502 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . 0.482 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 4.0 t80 -65.42 -42.26 92.69 Favored 'General case' 0 N--CA 1.411 -2.424 0 CA-C-N 112.467 -2.151 . . . . 0.0 109.706 -177.212 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -81.6 -32.21 32.16 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.181 -176.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 35.1 m -83.45 -51.29 7.49 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.9 t -128.93 99.06 4.53 Favored 'Isoleucine or valine' 0 C--O 1.244 0.777 0 C-N-CA 118.067 -1.453 . . . . 0.0 113.363 -170.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 35.8 t70 34.26 87.04 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 127.701 2.4 . . . . 0.0 116.929 172.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 5.9 ptmt -90.14 -43.49 10.42 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 177.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.82 -61.53 2.55 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 -161.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -78.94 -10.99 59.98 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 118.769 -1.172 . . . . 0.0 110.723 -174.128 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -86.04 -17.02 36.33 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.778 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 30.3 m -63.02 113.73 3.27 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -174.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -94.49 150.06 20.63 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 171.718 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -57.88 -34.15 69.46 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.276 0.489 . . . . 0.0 111.025 -177.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 82.8 t60 -64.99 -50.37 66.6 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 124.138 0.975 . . . . 0.0 109.726 -178.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -64.65 -31.09 72.16 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.747 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -65.38 -35.61 81.48 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.459 ' CG ' HD11 ' A' ' 535' ' ' LEU . 12.0 m-85 -59.21 -43.47 92.26 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.686 173.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 9.7 t -61.73 -46.22 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 120.368 -0.533 . . . . 0.0 109.724 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -49.05 -44.44 41.72 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 123.406 0.441 . . . . 0.0 110.625 175.113 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -60.3 -48.28 82.43 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.035 -179.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.467 HG21 ' CE2' ' A' ' 529' ' ' TYR . 2.9 t -57.19 -43.49 81.82 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.847 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.62 ' O ' ' HB3' ' A' ' 514' ' ' PHE . 94.7 mt -73.27 -34.27 65.71 Favored 'General case' 0 CA--C 1.565 1.544 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -176.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 30.3 t60 -67.43 -42.92 82.39 Favored 'General case' 0 C--O 1.259 1.566 0 CA-C-O 122.257 1.027 . . . . 0.0 108.541 174.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.65 -25.42 65.71 Favored 'General case' 0 C--O 1.172 -3.019 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.52 174.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . 0.824 ' O ' ' HA ' ' A' ' 518' ' ' ASN . 34.0 t80 -71.19 -16.39 62.52 Favored 'General case' 0 C--O 1.18 -2.58 0 C-N-CA 127.096 2.159 . . . . 0.0 111.459 174.97 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -79.85 -44.5 20.39 Favored 'General case' 0 C--N 1.28 -2.429 0 O-C-N 121.406 -0.809 . . . . 0.0 110.747 167.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.84 -53.48 32.09 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 123.119 1.438 . . . . 0.0 108.692 175.299 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -95.33 63.64 2.58 Favored 'General case' 0 C--N 1.281 -2.404 0 C-N-CA 129.003 2.921 . . . . 0.0 104.842 173.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . 0.824 ' HA ' ' O ' ' A' ' 514' ' ' PHE . 12.0 t-20 -59.32 -148.18 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.352 0 C-N-CA 129.886 3.275 . . . . 0.0 114.673 -164.346 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . 0.64 ' OD2' ' HG3' ' A' ' 520' ' ' GLN . 0.8 OUTLIER -34.07 -167.96 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.579 0 N-CA-C 120.079 3.363 . . . . 0.0 120.079 -136.817 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . 0.64 ' HG3' ' OD2' ' A' ' 519' ' ' ASP 0.313 59.0 mt-30 -59.44 135.68 57.74 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 120.941 3.682 . . . . 0.0 120.941 -146.456 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . 0.464 ' N ' ' HE1' ' A' ' 514' ' ' PHE . 5.2 t80 -41.61 133.37 2.67 Favored 'General case' 0 N--CA 1.416 -2.131 0 C-N-CA 131.09 3.756 . . . . 0.0 114.989 -177.181 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -119.25 163.91 16.42 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.336 172.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 5.7 tt -54.17 -32.83 23.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 C-N-CA 124.225 1.01 . . . . 0.0 111.002 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.456 ' HA ' HG12 ' A' ' 527' ' ' VAL . 34.8 p -59.48 -32.79 70.57 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.212 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -69.89 -44.07 70.49 Favored 'General case' 0 C--O 1.254 1.314 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -61.03 -51.4 69.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.869 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.456 HG12 ' HA ' ' A' ' 524' ' ' SER . 9.9 p -69.21 -13.62 17.47 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.0 0 C-N-CA 123.14 0.576 . . . . 0.0 110.747 177.788 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -69.71 -33.85 73.09 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.467 ' CE2' HG21 ' A' ' 510' ' ' VAL 0.256 1.0 OUTLIER -80.63 15.85 1.57 Allowed 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 172.392 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . . . . . . . . . 3.7 p -73.36 5.17 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.042 0 CA-C-O 121.699 0.761 . . . . 0.0 109.83 177.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . 0.422 ' H ' ' C ' ' A' ' 529' ' ' TYR . 58.8 t30 -95.55 -14.76 23.34 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.702 0.801 . . . . 0.0 110.745 -175.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 8.7 t -106.36 124.49 49.67 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 175.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -58.4 -44.04 88.84 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -170.266 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.25 -39.7 39.43 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -178.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.459 HD11 ' CG ' ' A' ' 506' ' ' TYR . 96.7 mt -67.36 -36.4 81.31 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-O 119.429 -0.32 . . . . 0.0 111.649 177.447 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 67.5 ttt180 -49.26 -67.53 0.26 Allowed 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 124.388 1.055 . . . . 0.0 110.522 179.219 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -62.13 -43.82 98.0 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.439 -176.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.457 ' O ' HD12 ' A' ' 542' ' ' LEU . 12.0 m -63.08 -54.62 35.16 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 120.217 -0.593 . . . . 0.0 112.542 -178.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.23 -37.01 85.55 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 38.5 mm -68.14 -38.87 80.38 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 70.1 m -57.03 -41.05 77.89 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.192 0.52 . . . . 0.0 110.741 171.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.457 HD12 ' O ' ' A' ' 538' ' ' THR . 7.8 mp -70.65 -24.77 62.77 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 123.198 0.599 . . . . 0.0 112.129 176.343 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -84.86 -35.87 21.93 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.658 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -71.33 29.51 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -176.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -61.93 148.67 42.9 Favored 'General case' 0 C--O 1.257 1.481 0 CA-C-O 121.707 0.765 . . . . 0.0 111.894 -175.187 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . 0.423 ' C ' ' H ' ' A' ' 548' ' ' ASN . 63.8 t30 -84.04 -176.37 6.24 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.351 -171.143 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . 0.453 ' C ' ' H ' ' A' ' 549' ' ' ASP . 7.4 mp -72.27 17.97 0.1 Allowed 'General case' 0 C--O 1.205 -1.253 0 C-N-CA 124.461 1.105 . . . . 0.0 112.458 -179.132 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . 0.449 ' C ' ' H ' ' A' ' 550' ' ' GLU . 17.0 m120 -75.04 20.83 0.13 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.149 0.98 . . . . 0.0 111.774 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . 0.453 ' H ' ' C ' ' A' ' 547' ' ' LEU . 25.1 t70 -72.69 33.06 0.07 Allowed 'General case' 0 CA--C 1.569 1.689 0 C-N-CA 125.972 1.709 . . . . 0.0 111.911 -176.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.449 ' H ' ' C ' ' A' ' 548' ' ' ASN . 17.0 mm-40 -73.94 170.54 14.09 Favored Pre-proline 0 C--N 1.304 -1.387 0 C-N-CA 124.852 1.261 . . . . 0.0 108.649 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -69.27 73.97 1.1 Allowed 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 121.862 1.708 . . . . 0.0 110.21 171.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -96.24 42.33 1.09 Allowed 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 126.495 1.918 . . . . 0.0 108.356 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . 0.563 ' O ' HG12 ' A' ' 556' ' ' ILE . 50.3 mt-10 -71.44 1.02 6.97 Favored 'General case' 0 C--N 1.281 -2.41 0 CA-C-N 114.633 -1.167 . . . . 0.0 112.464 -178.35 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . 0.417 ' O ' ' HB2' ' A' ' 557' ' ' ASP . 15.6 m120 -68.36 -21.47 64.72 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.956 1.702 . . . . 0.0 108.909 171.741 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -46.01 -49.18 16.39 Favored 'General case' 0 C--N 1.347 0.498 0 C-N-CA 124.065 0.946 . . . . 0.0 110.476 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . 0.563 HG12 ' O ' ' A' ' 553' ' ' GLU . 45.4 pt -64.67 -36.46 77.55 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 C-N-CA 123.342 0.657 . . . . 0.0 110.852 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . 0.429 ' OD1' HD13 ' A' ' 594' ' ' LEU . 14.3 m-20 -61.31 -50.9 71.09 Favored 'General case' 0 C--O 1.251 1.167 0 C-N-CA 123.533 0.733 . . . . 0.0 110.693 178.146 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . 0.448 ' O ' HG21 ' A' ' 562' ' ' VAL . 13.1 t70 -66.99 -42.89 84.3 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.733 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.623 ' CZ ' HG13 ' A' ' 563' ' ' ILE . 52.9 t80 -54.19 -53.85 47.88 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.936 178.009 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 32.0 t -55.12 -47.46 77.22 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.383 0 C-N-CA 122.796 0.438 . . . . 0.0 111.537 -177.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . 0.535 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 47.9 t30 -59.02 -47.24 85.94 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 122.342 0.257 . . . . 0.0 110.523 176.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . 0.448 HG21 ' O ' ' A' ' 558' ' ' ASP . 83.1 t -63.8 -41.76 93.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 121.436 0.636 . . . . 0.0 111.877 -178.543 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.623 HG13 ' CZ ' ' A' ' 559' ' ' TYR . 50.4 mm -83.25 -33.9 10.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.016 0 CA-C-O 121.489 0.662 . . . . 0.0 109.866 -172.694 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -73.95 -12.15 60.56 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.277 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.535 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 34.3 mt-10 -63.43 -15.75 58.57 Favored 'General case' 0 C--N 1.362 1.151 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.737 174.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -57.42 -25.96 60.4 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.339 175.161 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -129.96 -39.89 0.27 Allowed Glycine 0 N--CA 1.442 -0.919 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.899 -179.464 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 70.65 -71.95 0.12 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.756 1.623 . . . . 0.0 110.233 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 73.39 -77.18 0.06 Allowed 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 125.721 1.609 . . . . 0.0 114.009 174.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 570' ' ' THR . . . . . 0.476 ' O ' ' HG ' ' A' ' 574' ' ' LEU . 1.1 m -152.21 160.26 43.41 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 -177.048 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 48.6 mm -56.82 -45.7 83.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 121.961 0.886 . . . . 0.0 109.211 173.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -68.03 -34.55 76.69 Favored 'General case' 0 N--CA 1.422 -1.826 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.649 -173.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 22.8 t -62.95 -38.25 90.3 Favored 'General case' 0 C--O 1.259 1.554 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.341 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 570' ' ' THR . 43.8 mt -60.7 -53.01 62.59 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 175.504 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -52.62 -50.38 63.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.126 -1.397 . . . . 0.0 112.759 -174.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 47.6 t60 -59.8 -50.95 71.81 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.462 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -67.55 -32.37 73.09 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -176.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 7.8 mp -60.89 -52.56 64.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.214 0.53 . . . . 0.0 110.462 174.062 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.405 ' HB3' ' HE3' ' A' ' 591' ' ' LYS . 56.6 mtm180 -63.95 -35.06 79.43 Favored 'General case' 0 C--O 1.245 0.848 0 CA-C-O 122.221 1.01 . . . . 0.0 111.151 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . 0.479 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 6.0 tp10 -64.87 -33.28 75.63 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.108 178.454 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -63.38 -50.49 69.7 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.783 174.237 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.414 ' C ' ' H ' ' A' ' 584' ' ' ILE 0.254 0.7 OUTLIER -59.82 -24.27 64.02 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -178.555 . . . . . . . . 4 4 . 1 . 015 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.479 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 10.9 ttp85 -43.34 -9.02 0.01 OUTLIER 'General case' 0 CA--C 1.605 3.062 0 C-N-CA 124.846 1.259 . . . . 0.0 114.227 169.658 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . 0.414 ' H ' ' C ' ' A' ' 582' ' ' THR . 2.5 pp -68.7 10.25 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 N-CA-C 115.186 1.55 . . . . 0.0 115.186 -176.248 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 130.01 -54.71 0.78 Allowed Glycine 0 C--N 1.289 -2.03 0 C-N-CA 120.237 -0.982 . . . . 0.0 114.234 174.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . 0.478 ' OD2' ' HB3' ' A' ' 589' ' ' LEU . 20.7 t70 -86.33 81.15 8.47 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 118.092 -1.443 . . . . 0.0 109.111 176.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.624 ' O ' ' HB3' ' A' ' 591' ' ' LYS . 96.5 t -73.18 -51.54 25.68 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.331 0 CA-C-N 113.635 -1.62 . . . . 0.0 111.207 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -62.01 -57.16 12.72 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -169.584 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . 0.478 ' HB3' ' OD2' ' A' ' 586' ' ' ASP . 50.6 tp -73.21 -64.07 1.05 Allowed 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -175.75 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -51.86 -58.68 5.76 Favored 'General case' 0 CA--C 1.495 -1.158 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.41 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.624 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 83.8 tttt -63.71 -40.08 95.87 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-O 118.072 -0.966 . . . . 0.0 111.007 -173.508 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -53.01 -55.35 24.26 Favored 'General case' 0 C--N 1.362 1.139 0 CA-C-N 118.797 0.726 . . . . 0.0 111.469 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . 0.438 ' O ' HG13 ' A' ' 597' ' ' ILE . 63.6 m-85 -61.61 -52.08 65.85 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 120.804 0.335 . . . . 0.0 111.831 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . 0.429 HD13 ' OD1' ' A' ' 557' ' ' ASP . 56.9 mt -62.91 -41.83 99.58 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.193 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . 0.595 ' HG2' ' O ' ' A' ' 591' ' ' LYS . 13.2 pt20 -71.44 -35.27 70.87 Favored 'General case' 0 C--O 1.217 -0.651 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.35 177.926 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -67.05 -39.12 86.86 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.503 0.186 . . . . 0.0 111.503 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 593' ' ' TYR . 70.9 mt -55.51 -55.83 15.11 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.272 175.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 9.5 p -67.91 -32.14 55.07 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.759 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . 0.491 ' O ' ' HG3' ' A' ' 602' ' ' LYS . . . -62.87 -44.53 95.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.148 0.499 . . . . 0.0 110.699 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -70.45 -34.52 72.54 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.956 178.012 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -66.69 -42.3 86.71 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.77 0.319 . . . . 0.0 111.231 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.491 ' HG3' ' O ' ' A' ' 599' ' ' ALA . 0.0 OUTLIER -69.57 -30.35 68.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 0.0 110.198 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -72.52 -32.59 66.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.907 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -74.38 -4.9 39.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.069 -176.793 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 95.7 mmm . . . . . 0 C--O 1.255 1.349 0 CA-C-O 118.446 -0.788 . . . . 0.0 109.385 -177.883 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 . . . . . 0 N--CA 1.439 -1.022 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -110.19 92.31 4.0 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 175.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -135.09 80.39 1.84 Allowed 'General case' 0 C--N 1.288 -2.106 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 -179.228 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 6.7 mp -69.45 99.44 1.24 Allowed 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 178.072 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 48.4 m -75.32 106.0 6.63 Favored 'General case' 0 N--CA 1.42 -1.938 0 CA-C-O 121.554 0.692 . . . . 0.0 111.087 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -69.82 -16.16 63.23 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.404 175.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -59.66 -48.31 82.19 Favored 'General case' 0 C--O 1.189 -2.087 0 O-C-N 123.415 0.447 . . . . 0.0 110.075 173.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -60.0 -30.66 69.29 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-O 122.181 0.991 . . . . 0.0 109.887 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 28.3 mmtm -72.85 -32.13 65.24 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.374 174.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.49 -44.51 64.57 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.963 -178.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . 0.433 ' O ' ' HB2' ' A' ' 477' ' ' LEU . 3.0 mp0 -55.6 -44.97 77.5 Favored 'General case' 0 C--N 1.349 0.581 0 O-C-N 123.349 0.406 . . . . 0.0 110.026 173.85 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -44.83 95.48 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -64.01 -51.19 65.38 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.752 0.31 . . . . 0.0 111.053 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -18.97 64.58 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-O 121.337 0.589 . . . . 0.0 111.758 -179.571 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . 0.481 HD13 ' O ' ' A' ' 477' ' ' LEU . 3.0 tm? -77.25 -26.91 53.02 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 123.868 0.867 . . . . 0.0 110.423 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 33.8 tttm -53.65 -70.67 0.09 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.234 0.614 . . . . 0.0 111.012 -172.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . 0.428 ' HB3' ' CB ' ' A' ' 483' ' ' ASP . 32.5 m80 61.54 -170.53 0.16 Allowed 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.962 0.905 . . . . 0.0 112.347 176.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 91.5 mt -115.11 175.54 5.46 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 167.332 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 481' ' ' MET . . . . . 0.406 ' HG3' ' O ' ' A' ' 521' ' ' TYR . 1.6 mpt? -73.6 -17.81 61.13 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 121.472 0.653 . . . . 0.0 110.282 -178.921 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -65.12 -35.03 79.84 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.802 175.631 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.428 ' CB ' ' HB3' ' A' ' 479' ' ' HIS . 26.9 m-20 -70.85 52.79 0.15 Allowed 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 116.371 1.989 . . . . 0.0 116.371 -169.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -70.7 -42.45 70.63 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.83 -51.78 66.84 Favored 'General case' 0 CA--C 1.501 -0.938 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.797 177.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.424 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 6.0 m -59.73 -32.93 71.01 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.245 -177.768 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -59.94 -54.82 41.61 Favored 'General case' 0 C--N 1.347 0.464 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 173.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.98 -29.85 67.05 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.872 -178.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -65.02 -41.72 95.03 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 121.259 0.552 . . . . 0.0 109.794 -178.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -83.97 -37.91 21.66 Favored 'General case' 0 N--CA 1.411 -2.421 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.123 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -63.36 -40.08 96.29 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -73.63 -20.3 60.62 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.516 0.674 . . . . 0.0 110.305 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 39.4 m -79.02 -11.65 60.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.109 177.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . 0.476 HG13 ' HB2' ' A' ' 497' ' ' ASP . 55.1 t -94.97 129.85 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.234 0 CA-C-N 115.309 -0.859 . . . . 0.0 108.842 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -156.09 -60.37 0.1 Allowed 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.703 175.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -82.06 -19.68 39.79 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 122.103 0.954 . . . . 0.0 109.561 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . 0.476 ' HB2' HG13 ' A' ' 494' ' ' VAL . 0.6 OUTLIER -69.31 -0.9 6.89 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 126.203 1.801 . . . . 0.0 111.172 -177.523 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -75.59 19.6 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.295 0.638 . . . . 0.0 111.822 -179.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . 0.413 ' H ' ' C ' ' A' ' 497' ' ' ASP . 41.1 p90 -79.02 -16.99 56.11 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 173.737 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.6 t -58.96 168.41 1.3 Allowed 'General case' 0 CA--C 1.559 1.29 0 C-N-CA 124.843 1.257 . . . . 0.0 111.997 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.24 167.31 10.47 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -175.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -63.59 -12.84 36.31 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.572 1.549 . . . . 0.0 109.55 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -56.23 -44.34 79.51 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 124.721 1.208 . . . . 0.0 109.243 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -60.49 -34.87 74.69 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.954 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -70.12 -43.88 70.06 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -176.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.519 ' O ' HG21 ' A' ' 510' ' ' VAL . 73.9 m-85 -59.89 -46.16 90.21 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.448 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . 0.409 HG21 ' HG ' ' A' ' 477' ' ' LEU . 27.1 m -71.07 -47.17 63.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-O 118.916 -0.564 . . . . 0.0 112.282 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -51.53 -48.87 62.86 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 123.585 0.553 . . . . 0.0 111.835 176.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.91 -52.07 65.41 Favored 'General case' 0 C--O 1.242 0.694 0 O-C-N 124.029 0.83 . . . . 0.0 110.346 -178.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.519 HG21 ' O ' ' A' ' 506' ' ' TYR . 79.0 t -60.18 -50.85 78.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.311 178.067 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 92.5 mt -58.53 -55.77 30.78 Favored 'General case' 0 C--O 1.198 -1.625 0 O-C-N 124.078 0.861 . . . . 0.0 111.741 -176.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -59.95 -39.06 84.28 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.57 0.544 . . . . 0.0 111.694 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -66.04 -51.43 58.29 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.645 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -71.3 -39.29 71.55 Favored 'General case' 0 C--O 1.176 -2.804 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.871 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -53.19 -39.39 63.61 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 122.773 0.429 . . . . 0.0 110.419 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.15 -37.54 78.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -123.01 -2.31 8.7 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -171.11 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -150.2 -151.36 0.39 Allowed 'General case' 0 C--N 1.274 -2.698 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 -172.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.43 -163.71 1.08 Allowed 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 124.708 1.203 . . . . 0.0 111.868 -173.102 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.64 160.52 14.22 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . 0.406 ' O ' ' HG3' ' A' ' 481' ' ' MET . 4.0 t80 -41.74 132.2 3.01 Favored 'General case' 0 N--CA 1.415 -2.193 0 C-N-CA 126.816 2.046 . . . . 0.0 115.453 -179.195 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -116.83 159.15 22.79 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 171.015 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.4 pp -77.17 -18.91 14.37 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 CA-C-O 121.805 0.812 . . . . 0.0 108.819 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.499 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 8.0 m -57.14 -36.63 70.94 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.095 172.968 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -64.21 -38.34 90.69 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.343 0.592 . . . . 0.0 109.7 -179.179 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . 0.48 ' O ' HG12 ' A' ' 530' ' ' VAL . . . -60.95 -46.9 88.86 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.814 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.549 ' O ' HG21 ' A' ' 530' ' ' VAL . 82.7 t -61.95 -36.55 74.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 124.715 1.206 . . . . 0.0 111.444 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . 0.499 ' HG3' ' O ' ' A' ' 524' ' ' SER . 77.9 mt-30 -62.86 -36.08 82.08 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.651 0.739 . . . . 0.0 110.067 178.03 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.521 ' CG ' ' HD3' ' A' ' 536' ' ' ARG . 0.3 OUTLIER -76.15 -15.01 60.15 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.68 -176.755 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.549 HG21 ' O ' ' A' ' 527' ' ' VAL . 17.3 m -86.19 18.29 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 N-CA-C 116.037 1.865 . . . . 0.0 116.037 -170.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -96.99 -27.23 14.71 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 105.588 -2.005 . . . . 0.0 105.588 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 532' ' ' SER . . . . . 0.469 ' C ' ' H ' ' A' ' 534' ' ' GLU . 14.9 m -92.8 -142.33 0.21 Allowed 'General case' 0 C--N 1.292 -1.923 0 C-N-CA 128.871 2.868 . . . . 0.0 107.007 174.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . 0.512 ' C ' ' H ' ' A' ' 535' ' ' LEU . 13.4 m120 -29.08 28.08 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.851 1 C-N-CA 136.365 5.866 . . . . 0.0 117.559 173.161 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . 0.712 ' O ' ' HG3' ' A' ' 537' ' ' GLU . 10.4 pt-20 -33.28 2.27 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.633 0 C-N-CA 131.32 3.848 . . . . 0.0 116.348 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.512 ' H ' ' C ' ' A' ' 533' ' ' ASN . 3.1 pp -64.93 -17.19 64.14 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 162.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . 0.521 ' HD3' ' CG ' ' A' ' 529' ' ' TYR . 21.0 ttt180 -80.52 -11.99 59.59 Favored 'General case' 0 N--CA 1.402 -2.855 0 CA-C-N 113.149 -1.841 . . . . 0.0 111.288 174.274 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . 0.712 ' HG3' ' O ' ' A' ' 534' ' ' GLU . 0.1 OUTLIER -79.15 -32.35 44.3 Favored 'General case' 0 CA--C 1.475 -1.909 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 171.921 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.463 ' HB ' ' O ' ' A' ' 535' ' ' LEU . 62.4 m -59.54 -43.22 93.54 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 114.663 -1.153 . . . . 0.0 109.189 170.328 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 11.2 tp -56.75 -40.51 75.92 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.136 175.224 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . 0.417 HD13 ' HA ' ' A' ' 527' ' ' VAL . 80.6 mt -61.17 -49.24 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 C-N-CA 122.81 0.444 . . . . 0.0 110.391 176.071 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.4 m -54.26 -43.23 70.8 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.854 0.835 . . . . 0.0 110.668 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 34.5 tp -72.75 -25.4 61.18 Favored 'General case' 0 CA--C 1.565 1.556 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.208 177.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -79.73 -28.09 40.54 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.717 1.207 . . . . 0.0 109.656 -178.346 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -68.45 -27.49 66.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.739 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -65.76 115.01 5.45 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.177 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . 0.429 ' ND2' ' HB2' ' A' ' 549' ' ' ASP . 58.1 t30 -109.06 82.56 1.61 Allowed 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.317 -174.757 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -84.48 -15.4 46.14 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.735 176.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -78.71 -3.1 42.53 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.443 -178.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . 0.429 ' HB2' ' ND2' ' A' ' 546' ' ' ASN . 19.0 t70 -62.57 -44.06 97.27 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.903 0.859 . . . . 0.0 109.187 176.162 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -85.34 156.87 59.51 Favored Pre-proline 0 C--N 1.291 -1.956 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -50.89 112.03 0.68 Allowed 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 122.277 1.984 . . . . 0.0 108.816 173.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -118.46 31.81 6.47 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.636 0.731 . . . . 0.0 110.109 -169.571 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -70.91 -6.09 35.75 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.677 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -66.34 -20.73 66.16 Favored 'General case' 0 C--O 1.214 -0.79 0 C-N-CA 124.984 1.314 . . . . 0.0 109.617 171.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -37.78 -54.29 1.24 Allowed 'General case' 0 C--O 1.204 -1.306 0 C-N-CA 123.798 0.839 . . . . 0.0 113.026 179.733 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 20.5 mt -67.61 -42.64 86.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -176.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -56.06 -52.46 64.17 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.898 0.748 . . . . 0.0 110.121 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -65.03 -57.88 7.52 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.745 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.433 ' O ' HG13 ' A' ' 563' ' ' ILE . 74.9 t80 -50.99 -54.14 27.08 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 124.932 1.293 . . . . 0.0 112.615 -176.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . 0.484 ' HB ' HD21 ' A' ' 578' ' ' LEU . 53.1 t -71.52 -40.65 72.0 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.386 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.594 -176.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -60.29 -34.82 74.3 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 117.959 0.345 . . . . 0.0 110.686 178.7 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.26 -36.5 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 121.383 0.611 . . . . 0.0 111.907 177.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.433 HG13 ' O ' ' A' ' 559' ' ' TYR . 60.2 mt -84.63 -36.5 11.62 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.01 0 CA-C-O 122.204 1.002 . . . . 0.0 108.328 -176.09 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -81.56 7.21 12.68 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.348 176.34 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -71.66 -20.3 61.97 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 172.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -95.24 33.6 1.53 Allowed 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 113.925 -1.489 . . . . 0.0 107.383 172.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -75.86 64.58 2.65 Favored Glycine 0 CA--C 1.501 -0.824 0 C-N-CA 124.957 1.265 . . . . 0.0 116.089 -170.653 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -87.88 -178.17 5.96 Favored 'General case' 0 C--N 1.281 -2.404 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 168.673 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -56.36 149.81 15.97 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 118.405 0.548 . . . . 0.0 109.737 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 44.3 m 84.68 -40.87 0.06 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.804 1.242 . . . . 0.0 109.612 -174.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 12.5 mm -88.71 -31.3 5.5 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.053 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -177.187 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -60.24 -15.71 27.17 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 125.17 1.388 . . . . 0.0 110.801 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 9.4 m -63.57 -32.0 73.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 174.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 79.4 mt -66.0 -42.51 89.63 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.711 177.339 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . 0.463 ' O ' ' HB2' ' A' ' 578' ' ' LEU . 65.2 t30 -58.33 -43.81 88.39 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.935 0.874 . . . . 0.0 109.328 177.803 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -58.29 -48.49 80.29 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.942 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -60.15 -35.12 74.59 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.287 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.484 HD21 ' HB ' ' A' ' 560' ' ' VAL . 26.6 mt -53.84 -51.98 61.84 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.599 0.238 . . . . 0.0 111.262 174.262 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.423 ' HD2' ' O ' ' A' ' 575' ' ' ASN . 0.0 OUTLIER -60.74 -44.15 97.02 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.226 -179.859 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . 0.586 ' O ' ' HG3' ' A' ' 583' ' ' ARG . 37.0 tt0 -68.04 -53.74 23.51 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.728 -178.138 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -60.63 -31.01 70.23 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -179.047 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 582' ' ' THR . . . . . . . . . . . . 0.266 1.8 m -81.36 -26.45 35.52 Favored 'General case' 0 C--O 1.175 -2.846 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 179.072 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.586 ' HG3' ' O ' ' A' ' 580' ' ' GLU 0.267 0.0 OUTLIER -56.95 -24.19 50.98 Favored 'General case' 0 CA--C 1.577 1.992 0 CA-C-O 122.981 1.372 . . . . 0.0 112.207 178.156 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . 0.355 12.7 tt -85.43 65.88 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.101 0 C-N-CA 129.294 3.037 . . . . 0.0 109.365 167.75 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 144.65 68.78 0.02 OUTLIER Glycine 0 C--N 1.351 1.411 0 CA-C-O 125.165 2.536 . . . . 0.0 107.323 -144.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -52.59 172.95 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.268 1 C-N-CA 132.081 4.152 . . . . 0.0 112.136 -163.808 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.1 p -17.21 -3.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.529 3.5 1 C-N-CA 132.409 4.284 . . . . 0.0 119.465 -139.68 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -63.71 -29.33 70.57 Favored 'General case' 0 C--O 1.204 -1.29 0 N-CA-C 103.671 -2.715 . . . . 0.0 103.671 153.798 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . 0.418 ' HG ' ' N ' ' A' ' 590' ' ' GLN . 0.1 OUTLIER -49.98 -47.29 52.85 Favored 'General case' 0 C--O 1.197 -1.664 0 C-N-CA 126.825 2.05 . . . . 0.0 110.304 169.965 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . 0.418 ' N ' ' HG ' ' A' ' 589' ' ' LEU . 50.0 tt0 -57.64 -47.58 81.85 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -59.3 -48.12 82.82 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.161 176.232 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -60.29 -40.53 90.79 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -60.29 -43.22 96.48 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 123.429 0.692 . . . . 0.0 110.104 175.087 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . 0.406 ' O ' ' HB ' ' A' ' 597' ' ' ILE . 50.8 tp -60.31 -42.94 96.6 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 122.088 0.947 . . . . 0.0 109.234 175.02 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 26.6 mt-30 -67.66 -26.08 66.03 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.278 178.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -68.62 -40.21 80.46 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 174.746 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . 0.406 ' HB ' ' O ' ' A' ' 594' ' ' LEU . 75.8 mt -57.17 -47.72 83.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.101 175.009 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 4.3 p -69.64 -28.38 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 120.551 -0.46 . . . . 0.0 111.1 178.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . 0.572 ' O ' ' HB3' ' A' ' 602' ' ' LYS . . . -67.22 -37.14 83.11 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.922 0.868 . . . . 0.0 109.766 174.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -68.43 -39.03 81.7 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.316 174.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -64.88 -27.82 69.12 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 121.973 0.892 . . . . 0.0 110.042 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.572 ' HB3' ' O ' ' A' ' 599' ' ' ALA . 3.8 tmtm? -68.41 -49.69 58.15 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 174.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . 0.423 ' C ' ' H ' ' A' ' 605' ' ' MET . 47.2 mt-10 -82.71 6.99 16.18 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 179.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -71.08 44.65 0.09 Allowed 'General case' 0 CA--C 1.561 1.392 0 CA-C-O 122.858 1.313 . . . . 0.0 110.971 177.539 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 605' ' ' MET . . . . . 0.423 ' H ' ' C ' ' A' ' 603' ' ' GLU . 18.1 ptp . . . . . 0 C--N 1.283 -2.313 0 CA-C-N 114.856 -1.066 . . . . 0.0 108.321 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 32.6 p90 . . . . . 0 C--O 1.247 0.966 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -81.83 163.14 22.54 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.984 177.297 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -127.9 78.39 1.82 Allowed 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 -179.53 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 7.1 mp -69.65 99.67 1.35 Allowed 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 18.4 m -71.06 135.58 47.82 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -174.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 19.6 mmt85 -60.12 -38.79 84.09 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 123.138 1.447 . . . . 0.0 107.199 173.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.475 ' HG3' ' HA ' ' A' ' 563' ' ' ILE . 18.3 mp0 -64.14 -21.76 66.67 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 112.768 -2.015 . . . . 0.0 111.555 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.658 ' O ' ' HG2' ' A' ' 474' ' ' ARG . 55.3 tt0 -66.28 -40.79 90.32 Favored 'General case' 0 C--O 1.209 -1.047 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -62.58 -41.53 99.0 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -58.17 -46.26 86.04 Favored 'General case' 0 C--O 1.243 0.738 0 O-C-N 123.675 0.609 . . . . 0.0 109.89 175.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -57.57 -50.29 73.59 Favored 'General case' 0 C--O 1.2 -1.548 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.957 175.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.658 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 18.7 mmm-85 -59.18 -32.0 69.51 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 120.77 0.319 . . . . 0.0 110.327 -178.108 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -66.02 -57.59 7.41 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . 0.402 ' HB3' ' HB2' ' A' ' 490' ' ' TYR . 1.4 m-85 -62.53 -35.4 79.31 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 178.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 25.8 tp -73.17 -9.0 58.25 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 124.941 1.296 . . . . 0.0 112.352 -176.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -46.51 -40.04 11.85 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.207 1.003 . . . . 0.0 113.577 -179.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . 0.512 ' HA ' HG22 ' A' ' 486' ' ' THR 0.256 0.3 OUTLIER 84.76 130.15 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 126.574 1.949 . . . . 0.0 111.753 -177.153 . . . . . . . . 4 4 . 1 . 017 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -93.42 -96.25 0.15 Allowed 'General case' 0 N--CA 1.427 -1.591 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.406 175.188 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 481' ' ' MET . . . . . . . . . . . . 0.398 0.5 OUTLIER -95.84 -91.37 0.22 Allowed 'General case' 0 CA--C 1.472 -2.04 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 179.905 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . 0.606 ' HB3' ' O ' ' A' ' 519' ' ' ASP . 12.6 mtm180 -79.04 -100.33 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.668 0 C-N-CA 116.689 -2.004 . . . . 0.0 111.202 -174.405 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.5 ' HB3' ' HB2' ' A' ' 519' ' ' ASP . 10.1 t70 -142.46 -54.72 0.43 Allowed 'General case' 0 C--N 1.296 -1.74 0 C-N-CA 123.453 0.701 . . . . 0.0 109.262 173.927 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 34.3 tttm -34.53 -66.45 0.17 Allowed 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 113.046 -1.888 . . . . 0.0 113.746 -170.43 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -58.95 -52.9 63.79 Favored 'General case' 0 C--O 1.202 -1.442 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.546 -173.364 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.512 HG22 ' HA ' ' A' ' 479' ' ' HIS . 93.8 m -61.03 -48.15 83.09 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.778 -177.902 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -54.92 -59.09 5.21 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 124.431 1.082 . . . . 0.0 108.959 -177.036 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 85.0 mt -68.65 -27.64 66.18 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.421 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -64.36 -30.8 71.83 Favored 'General case' 0 CA--C 1.489 -1.375 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . 0.435 ' O ' HG21 ' A' ' 494' ' ' VAL . 2.0 t80 -95.53 -53.43 3.74 Favored 'General case' 1 N--CA 1.367 -4.613 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 176.484 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -63.96 -40.24 95.95 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 124.747 1.219 . . . . 0.0 114.146 -167.64 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -81.93 -10.68 59.2 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.436 0.636 . . . . 0.0 112.17 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 17.8 m -84.84 -11.76 54.98 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.05 176.209 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 490' ' ' TYR . 23.9 t -113.72 109.39 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.863 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.256 -176.824 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -95.23 -17.1 22.0 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -89.56 20.61 3.86 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 113.329 -1.76 . . . . 0.0 111.647 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -58.51 -6.9 0.78 Allowed 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -174.168 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.57 -9.82 59.69 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 120.898 -1.126 . . . . 0.0 110.58 176.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -82.22 -9.41 59.51 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.783 176.511 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 20.4 p -56.14 160.91 2.66 Favored 'General case' 0 C--O 1.25 1.103 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -174.586 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.744 ' OD1' ' HB2' ' A' ' 503' ' ' HIS . 8.0 p30 -91.64 161.73 14.79 Favored 'General case' 0 N--CA 1.416 -2.145 0 CA-C-N 114.03 -1.441 . . . . 0.0 111.03 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -77.42 -23.31 50.62 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.571 0.7 . . . . 0.0 109.623 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . 0.744 ' HB2' ' OD1' ' A' ' 501' ' ' ASN . 32.3 m170 -61.42 -46.24 90.94 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 175.724 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . 0.429 ' CE1' ' CE1' ' A' ' 490' ' ' TYR . 72.2 t80 -57.65 -35.43 70.53 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.266 -1.334 . . . . 0.0 111.197 173.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -63.93 -48.85 74.94 Favored 'General case' 0 CA--C 1.482 -1.652 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -175.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.47 ' O ' HG21 ' A' ' 510' ' ' VAL . 0.2 OUTLIER -61.32 -37.67 84.09 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 118.283 -1.367 . . . . 0.0 110.17 -179.076 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . 0.45 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 23.3 t -66.85 -54.53 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 120.291 -0.563 . . . . 0.0 110.785 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -48.97 -39.87 28.23 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.849 0.86 . . . . 0.0 110.873 176.339 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -59.52 -56.34 23.2 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.362 1.065 . . . . 0.0 110.376 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.47 HG21 ' O ' ' A' ' 506' ' ' TYR . 2.5 t -64.44 -41.16 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.445 178.376 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.45 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 83.7 mt -58.75 -53.78 54.49 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.251 0.548 . . . . 0.0 111.488 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -62.82 -32.13 73.27 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.695 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.32 -40.98 98.12 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 120.773 0.321 . . . . 0.0 110.254 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . 0.442 ' CE2' HG12 ' A' ' 510' ' ' VAL . 33.4 m-85 -69.11 -57.09 5.86 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -49.03 -34.53 13.56 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.893 1.277 . . . . 0.0 111.307 -178.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.06 -23.97 66.63 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -112.38 -58.01 2.2 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.45 0.643 . . . . 0.0 110.021 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -158.01 121.54 4.01 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 125.345 1.458 . . . . 0.0 108.352 175.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . 0.606 ' O ' ' HB3' ' A' ' 482' ' ' ARG . 1.9 p30 -77.78 98.72 5.64 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-O 121.064 0.459 . . . . 0.0 111.698 -172.231 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -143.04 140.97 31.19 Favored 'General case' 0 CA--C 1.491 -1.315 0 O-C-N 121.437 -0.79 . . . . 0.0 110.938 167.826 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -85.0 105.9 16.1 Favored 'General case' 0 N--CA 1.402 -2.864 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 170.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -85.5 110.41 19.18 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -177.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 5.0 tt -55.85 -33.32 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 C-N-CA 124.58 1.152 . . . . 0.0 110.907 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.58 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 48.1 t -58.34 -38.64 77.56 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.083 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -65.26 -43.57 90.84 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . 0.448 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -58.11 -52.47 65.43 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.137 179.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.533 ' O ' HG22 ' A' ' 530' ' ' VAL . 8.9 p -67.77 -24.02 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 CA-C-O 121.063 0.459 . . . . 0.0 111.88 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . 0.58 ' HG3' ' O ' ' A' ' 524' ' ' SER . 26.2 mt-30 -67.65 -26.62 66.31 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 121.144 -0.972 . . . . 0.0 109.484 172.879 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.448 ' HB2' ' O ' ' A' ' 526' ' ' ALA . 47.5 m-85 -75.01 -0.49 19.0 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 118.136 -0.935 . . . . 0.0 112.659 174.416 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.642 ' HA ' ' NH1' ' A' ' 536' ' ' ARG . 32.3 m -72.37 20.88 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.532 3.666 0 N-CA-C 116.589 2.07 . . . . 0.0 116.589 -173.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -128.99 -40.5 1.5 Allowed 'General case' 0 C--N 1.278 -2.521 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 173.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.58 -144.62 0.03 OUTLIER 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 128.729 2.812 . . . . 0.0 112.062 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . 0.571 ' C ' ' H ' ' A' ' 535' ' ' LEU . 45.3 t30 -27.8 31.42 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 1 C-N-CA 138.496 6.719 . . . . 0.0 117.578 176.817 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -31.76 8.87 0.0 OUTLIER 'General case' 0 N--CA 1.536 3.854 0 C-N-CA 130.992 3.717 . . . . 0.0 117.045 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.571 ' H ' ' C ' ' A' ' 533' ' ' ASN . 45.5 mt -63.76 -26.84 68.82 Favored 'General case' 0 C--N 1.283 -2.295 0 N-CA-C 103.167 -2.901 . . . . 0.0 103.167 162.766 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . 0.642 ' NH1' ' HA ' ' A' ' 530' ' ' VAL . 1.4 ttp180 -56.27 -39.55 72.81 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 111.887 -2.415 . . . . 0.0 110.985 169.094 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -60.96 -47.04 88.28 Favored 'General case' 0 CA--C 1.481 -1.706 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 -179.044 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.471 ' O ' HD12 ' A' ' 542' ' ' LEU . 24.4 m -55.81 -48.15 75.91 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 114.295 -1.32 . . . . 0.0 109.832 174.853 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . 0.545 ' O ' ' HB2' ' A' ' 542' ' ' LEU . 9.3 tt -60.54 -36.71 79.09 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . 0.467 HG12 ' O ' ' A' ' 536' ' ' ARG . 50.1 mm -66.88 -34.27 68.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 178.222 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 541' ' ' SER . . . . . 0.43 ' HB3' ' O ' ' A' ' 538' ' ' THR . 29.7 t -57.32 -40.01 77.0 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.104 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.545 ' HB2' ' O ' ' A' ' 539' ' ' LEU . 6.3 mp -60.58 -33.63 73.0 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.527 0.731 . . . . 0.0 109.955 175.665 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -80.08 -31.11 39.36 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -69.71 -33.65 72.8 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -64.01 114.05 3.88 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.256 170.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -107.1 138.22 43.68 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.247 -175.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 2.1 pt? -79.8 9.5 5.15 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.288 1.042 . . . . 0.0 110.511 177.618 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -68.81 -41.41 78.69 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.703 -1.135 . . . . 0.0 108.542 174.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -68.36 -60.52 2.38 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.744 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -125.21 119.78 25.12 Favored Pre-proline 0 N--CA 1.425 -1.723 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.276 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . 0.471 ' HB2' ' OE1' ' A' ' 553' ' ' GLU . 29.9 Cg_endo -63.49 -169.91 0.1 Allowed 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.233 2.622 . . . . 0.0 114.065 -177.707 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . 0.443 ' O ' HG13 ' A' ' 556' ' ' ILE . 47.1 p90 -91.55 -13.65 31.68 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -170.729 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . 0.471 ' OE1' ' HB2' ' A' ' 551' ' ' PRO . 2.0 mp0 -66.9 -42.86 84.75 Favored 'General case' 0 C--N 1.28 -2.435 0 CA-C-O 121.304 0.573 . . . . 0.0 110.416 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . 0.453 ' HA ' ' HG3' ' A' ' 583' ' ' ARG . 1.9 p-10 -69.16 -24.07 64.03 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.551 175.121 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . 0.45 ' HG3' ' O ' ' A' ' 551' ' ' PRO . 54.9 mt-10 -72.39 -46.78 53.72 Favored 'General case' 0 C--O 1.211 -0.927 0 C-N-CA 120.054 -0.658 . . . . 0.0 109.408 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 552' ' ' TYR . 64.8 mt -58.79 -49.17 83.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.116 0.566 . . . . 0.0 110.865 178.078 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -60.31 -52.53 64.88 Favored 'General case' 0 CA--C 1.508 -0.638 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.58 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -60.24 -43.35 96.17 Favored 'General case' 0 C--O 1.207 -1.161 0 O-C-N 123.862 0.726 . . . . 0.0 110.611 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.461 ' O ' HG13 ' A' ' 563' ' ' ILE . 50.4 t80 -54.43 -53.56 52.47 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 124.473 1.109 . . . . 0.0 110.813 176.446 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.9 t -65.21 -42.33 93.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.569 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -62.4 -42.43 99.42 Favored 'General case' 0 C--O 1.194 -1.861 0 C-N-CA 123.456 0.702 . . . . 0.0 110.087 -179.273 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . 0.571 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 40.9 t -64.89 -41.21 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 CA-C-O 121.656 0.741 . . . . 0.0 112.679 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.475 ' HA ' ' HG3' ' A' ' 469' ' ' GLN . 54.1 mt -76.32 -35.85 28.3 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.224 0 CA-C-O 122.136 0.969 . . . . 0.0 109.462 -174.778 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -90.93 -6.82 53.58 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.0 -176.728 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.571 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 11.8 pt-20 -76.6 -25.03 53.48 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -90.06 12.52 17.48 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.325 176.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -121.22 -55.59 0.23 Allowed Glycine 0 N--CA 1.431 -1.668 0 CA-C-N 115.54 -0.755 . . . . 0.0 112.286 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -87.05 157.35 19.44 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -175.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . 0.514 ' HG3' ' H ' ' A' ' 571' ' ' ILE . 9.8 tp10 -60.7 171.16 1.22 Allowed 'General case' 0 CA--C 1.58 2.133 0 C-N-CA 126.458 1.903 . . . . 0.0 113.36 -177.371 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 36.2 m -78.04 -10.99 59.87 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 124.543 1.137 . . . . 0.0 110.319 -178.606 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . 0.514 ' H ' ' HG3' ' A' ' 569' ' ' GLU . 5.0 mt -86.5 -31.34 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.763 0 N-CA-C 105.772 -1.936 . . . . 0.0 105.772 177.096 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -71.11 -22.2 62.12 Favored 'General case' 0 N--CA 1.4 -2.928 0 CA-C-N 113.584 -1.643 . . . . 0.0 110.389 174.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 52.3 m -61.7 -34.13 75.22 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.709 177.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 7.3 mp -65.11 -47.0 78.72 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 173.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -60.15 -40.29 89.33 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.434 178.198 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 9.2 m170 -57.89 -40.41 80.21 Favored 'General case' 0 C--O 1.197 -1.689 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.424 174.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 580' ' ' GLU . 40.2 ttmt -63.27 -49.44 74.06 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.103 0.561 . . . . 0.0 111.983 -177.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 8.7 mp -62.19 -43.76 98.1 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.231 0.538 . . . . 0.0 111.484 175.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.708 ' O ' ' HB ' ' A' ' 582' ' ' THR . 12.3 ttm105 -59.7 -34.32 72.75 Favored 'General case' 0 CA--C 1.565 1.553 0 CA-C-O 121.8 0.81 . . . . 0.0 110.73 174.534 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . 0.443 ' HB3' ' O ' ' A' ' 577' ' ' LYS . 32.3 tt0 -64.64 -33.41 75.87 Favored 'General case' 0 C--O 1.197 -1.691 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.494 177.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -67.42 -35.35 79.08 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.442 0.639 . . . . 0.0 110.58 172.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.708 ' HB ' ' O ' ' A' ' 579' ' ' ARG . 54.4 m -60.33 -28.42 68.14 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 125.201 1.401 . . . . 0.0 111.192 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.453 ' HG3' ' HA ' ' A' ' 554' ' ' ASN . 25.4 ttm180 -30.25 -34.41 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 127.594 2.358 . . . . 0.0 116.831 176.224 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 13.4 tt -74.36 -10.31 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.585 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -171.603 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 87.95 8.58 72.35 Favored Glycine 0 N--CA 1.477 1.396 0 C-N-CA 120.209 -0.996 . . . . 0.0 112.417 177.049 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -83.69 166.75 17.83 Favored 'General case' 0 C--N 1.284 -2.251 0 C-N-CA 125.45 1.5 . . . . 0.0 110.025 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.576 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 19.9 m -46.92 -6.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.36 1.03 0 C-N-CA 125.942 1.697 . . . . 0.0 114.172 177.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.32 -11.78 17.22 Favored 'General case' 0 CA--C 1.562 1.419 0 O-C-N 121.562 -0.711 . . . . 0.0 110.423 166.31 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . 0.486 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 9.3 mp -68.91 -36.79 78.43 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 167.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . 0.576 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 32.9 tt0 -60.58 -40.09 90.44 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 171.848 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -69.14 -27.22 65.36 Favored 'General case' 0 C--O 1.207 -1.18 0 CA-C-N 114.462 -1.245 . . . . 0.0 110.314 177.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.486 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 62.8 t80 -61.24 -41.65 97.26 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 120.993 0.425 . . . . 0.0 109.875 173.761 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . 0.417 ' O ' ' HB3' ' A' ' 596' ' ' GLN . 71.8 t80 -58.88 -42.71 90.13 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 174.336 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 60.7 tp -61.54 -41.86 97.97 Favored 'General case' 0 C--O 1.204 -1.326 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.407 175.42 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -61.92 -29.27 70.11 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.576 0.75 . . . . 0.0 111.947 178.856 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . 0.417 ' HB3' ' O ' ' A' ' 593' ' ' TYR . 35.5 tt0 -63.67 -52.81 59.01 Favored 'General case' 0 C--O 1.248 1.012 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 173.897 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 1.8 mp -58.93 -47.68 88.92 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 CA-C-N 114.834 -1.075 . . . . 0.0 111.339 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 71.1 t -60.62 -42.87 93.36 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 C-N-CA 123.206 0.603 . . . . 0.0 111.499 -178.747 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . 0.412 ' O ' ' HE2' ' A' ' 602' ' ' LYS . . . -60.81 -37.37 81.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.862 0.363 . . . . 0.0 110.279 177.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -68.39 -41.41 80.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.93 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . 0.537 ' O ' ' HB3' ' A' ' 604' ' ' ARG . 67.1 t30 -66.01 -34.24 77.65 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 122.225 1.012 . . . . 0.0 109.984 178.698 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.467 ' HE3' ' HG3' ' A' ' 603' ' ' GLU . 12.4 ttpt -65.42 -44.26 87.96 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.158 177.618 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . 0.467 ' HG3' ' HE3' ' A' ' 602' ' ' LYS . 13.2 mt-10 -79.22 -6.87 57.61 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.727 0.811 . . . . 0.0 112.471 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . 0.537 ' HB3' ' O ' ' A' ' 601' ' ' ASN . 62.7 ttt180 -77.69 -55.95 4.92 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 123.746 0.818 . . . . 0.0 111.147 177.28 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 68.1 mtm . . . . . 0 C--N 1.308 -1.218 0 CA-C-O 118.605 -0.712 . . . . 0.0 110.265 -176.38 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.434 -1.272 0 CA-C-O 121.59 0.709 . . . . 0.0 111.441 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -118.37 -141.69 0.36 Allowed 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -81.28 -134.02 0.03 OUTLIER 'General case' 0 N--CA 1.414 -2.247 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.017 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 50.5 mt -48.16 129.0 14.86 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 125.447 1.499 . . . . 0.0 110.311 -176.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 68.8 p -75.05 178.64 5.51 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.125 -175.064 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . 0.463 ' NH2' HG22 ' A' ' 562' ' ' VAL . 8.1 ptm85 -60.18 -40.94 91.77 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.527 ' NE2' ' HA ' ' A' ' 563' ' ' ILE . 67.0 mt-30 -70.36 -30.02 66.84 Favored 'General case' 0 C--O 1.212 -0.88 0 C-N-CA 119.041 -1.064 . . . . 0.0 111.429 176.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.438 ' OE2' ' HB2' ' A' ' 501' ' ' ASN . 48.5 mt-10 -70.72 -35.19 72.61 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 120.777 0.323 . . . . 0.0 111.104 176.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.455 ' HD3' ' HA ' ' A' ' 471' ' ' LYS . 20.5 mmtp -66.93 -33.45 75.61 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.834 173.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.0 -47.17 60.35 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.91 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -61.44 -44.44 97.1 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 120.515 0.198 . . . . 0.0 110.617 176.747 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.487 ' NE ' ' HB3' ' A' ' 542' ' ' LEU . 11.7 tpt180 -54.88 -42.23 71.84 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.778 173.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . 0.414 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . . . -64.43 -44.93 89.64 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-O 120.799 0.333 . . . . 0.0 110.692 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.24 -18.69 64.78 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.2 mt -71.08 -15.96 62.55 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 121.953 -0.467 . . . . 0.0 112.07 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.518 ' HB2' ' HZ1' ' A' ' 478' ' ' LYS . 10.0 mtmp? -77.78 26.15 0.19 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 122.984 0.514 . . . . 0.0 111.747 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 -86.88 14.0 8.03 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 122.881 0.472 . . . . 0.0 111.959 -175.164 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 97.1 mt 71.35 -174.55 0.17 Allowed 'General case' 0 C--O 1.245 0.863 0 C-N-CA 123.754 0.821 . . . . 0.0 110.729 -177.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 59.0 ttp -88.26 -36.31 16.79 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.86 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 25.2 ttp180 -57.48 -46.67 83.43 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.914 1.286 . . . . 0.0 114.313 -173.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.3 59.29 0.27 Allowed 'General case' 0 C--N 1.28 -2.422 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -171.59 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -57.55 -36.76 72.06 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 124.319 1.047 . . . . 0.0 111.54 177.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -57.19 -44.05 83.24 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.117 0.484 . . . . 0.0 109.702 176.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 28.9 m -64.6 -31.63 72.93 Favored 'General case' 0 N--CA 1.421 -1.911 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.231 -178.981 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -61.03 -50.93 71.33 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . 0.463 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 76.1 mt -74.33 -36.75 63.68 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.514 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -61.32 -42.96 99.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.276 0.63 . . . . 0.0 112.431 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -78.57 -38.58 39.91 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.636 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -55.19 -49.28 72.31 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.82 178.647 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . 0.463 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 12.6 pt-20 -79.29 -7.69 58.49 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -177.769 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 68.9 m -81.4 -14.88 56.65 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 122.121 0.962 . . . . 0.0 109.132 174.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . 0.463 HG11 ' HB2' ' A' ' 497' ' ' ASP . 33.1 t -100.08 133.78 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.376 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -149.5 -56.63 0.19 Allowed 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -88.46 -22.38 23.71 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 122.727 1.251 . . . . 0.0 108.347 178.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . 0.463 ' HB2' HG11 ' A' ' 494' ' ' VAL . 0.0 OUTLIER -72.96 -2.88 22.73 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 126.689 1.996 . . . . 0.0 109.365 178.191 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -77.68 22.51 0.26 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.147 0.979 . . . . 0.0 109.855 -176.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . 0.475 ' HE1' ' OE1' ' A' ' 469' ' ' GLN . 31.5 p90 -77.68 -9.75 59.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 500' ' ' THR . . . . . 0.405 HG22 ' CG ' ' A' ' 470' ' ' GLU . 1.1 p -54.48 166.97 0.37 Allowed 'General case' 0 N--CA 1.426 -1.661 0 C-N-CA 125.999 1.72 . . . . 0.0 115.115 -173.959 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.438 ' HB2' ' OE2' ' A' ' 470' ' ' GLU . 16.0 t-20 -64.38 146.99 53.57 Favored 'General case' 0 N--CA 1.429 -1.511 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.024 -175.042 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -64.05 -15.43 59.47 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-O 120.97 0.414 . . . . 0.0 111.306 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . 0.699 ' CE1' ' HG ' ' A' ' 535' ' ' LEU . 4.2 m-70 -65.54 -39.03 91.28 Favored 'General case' 0 C--O 1.203 -1.36 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.448 176.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -63.89 -36.62 84.54 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.508 0.67 . . . . 0.0 110.32 176.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -68.11 -41.33 81.91 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.783 176.545 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . 0.462 ' O ' HG22 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -60.81 -40.37 92.45 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.19 177.29 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . 0.469 ' O ' HD12 ' A' ' 511' ' ' LEU . 77.1 t -56.42 -56.47 13.48 Favored 'Isoleucine or valine' 0 C--N 1.341 0.217 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 173.622 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -45.62 -52.53 10.54 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 123.96 0.787 . . . . 0.0 111.747 174.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.47 -60.09 4.17 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 123.812 0.845 . . . . 0.0 112.539 -177.934 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . 0.462 HG22 ' O ' ' A' ' 506' ' ' TYR . 17.0 t -60.78 -43.71 95.9 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 CA-C-O 120.512 0.196 . . . . 0.0 110.99 -176.327 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.469 HD12 ' O ' ' A' ' 507' ' ' VAL . 10.8 mp -63.32 -49.66 73.08 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.062 -178.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -64.18 -35.9 82.29 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 123.86 0.725 . . . . 0.0 110.856 -177.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -60.98 -44.28 97.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.822 0.344 . . . . 0.0 111.523 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -74.48 -47.21 34.64 Favored 'General case' 0 C--O 1.183 -2.409 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 14.6 t80 -47.83 -37.41 13.75 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 125.674 1.59 . . . . 0.0 110.777 -179.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.56 -40.09 88.84 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -115.87 -40.6 3.31 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -172.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -106.02 -151.57 0.46 Allowed 'General case' 0 C--N 1.271 -2.83 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . 0.428 ' CG ' ' H ' ' A' ' 520' ' ' GLN . 13.7 t70 -105.17 -160.11 0.74 Allowed 'General case' 0 C--N 1.285 -2.228 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -177.331 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . 0.428 ' H ' ' CG ' ' A' ' 519' ' ' ASP . 88.2 mt-30 -78.04 166.86 22.3 Favored 'General case' 0 C--N 1.296 -1.753 0 C-N-CA 123.164 0.585 . . . . 0.0 112.359 -174.147 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -90.07 134.38 34.29 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 125.314 1.445 . . . . 0.0 111.511 -172.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.14 176.24 5.4 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.105 177.455 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . 0.494 HD11 ' H ' ' A' ' 523' ' ' ILE 0.303 0.2 OUTLIER -78.95 -14.16 13.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 119.25 -0.98 . . . . 0.0 113.379 -175.859 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 40.9 m -60.37 -36.0 77.03 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 121.228 0.537 . . . . 0.0 109.589 169.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -66.03 -43.32 87.92 Favored 'General case' 0 C--O 1.253 1.286 0 CA-C-O 122.362 1.077 . . . . 0.0 108.207 176.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . 0.465 ' O ' ' HD3' ' A' ' 536' ' ' ARG . . . -56.15 -52.54 64.01 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 113.675 -1.602 . . . . 0.0 111.658 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.69 ' O ' HG12 ' A' ' 530' ' ' VAL . 8.0 p -64.46 -30.67 50.83 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.928 0 CA-C-O 120.546 0.212 . . . . 0.0 111.026 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 81.3 mm-40 -66.83 -22.94 65.99 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.404 -0.81 . . . . 0.0 110.474 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.14 -3.18 41.18 Favored 'General case' 0 N--CA 1.441 -0.916 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 174.543 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.69 HG12 ' O ' ' A' ' 527' ' ' VAL 0.267 8.9 p -74.67 53.84 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.553 0 CA-C-O 122.918 1.342 . . . . 0.0 113.267 179.039 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -107.16 -33.99 7.27 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 14.7 t -91.77 109.23 20.55 Favored 'General case' 0 N--CA 1.421 -1.893 0 N-CA-C 102.278 -3.23 . . . . 0.0 102.278 163.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 20.5 m120 -62.62 -68.2 0.35 Allowed 'General case' 0 C--O 1.203 -1.369 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 -170.328 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -37.44 23.71 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 114.398 1.259 . . . . 0.0 114.398 -177.738 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.699 ' HG ' ' CE1' ' A' ' 503' ' ' HIS . 6.6 tt -62.06 -68.01 0.36 Allowed 'General case' 0 C--O 1.266 1.928 0 C-N-CA 124.19 0.996 . . . . 0.0 109.897 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . 0.465 ' HD3' ' O ' ' A' ' 526' ' ' ALA . 3.7 tpm_? -69.86 -31.29 69.05 Favored 'General case' 0 N--CA 1.412 -2.33 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.843 -175.9 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -56.06 -58.34 8.35 Favored 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.9 0.75 . . . . 0.0 110.056 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 75.5 m -56.38 -49.04 75.58 Favored 'General case' 0 N--CA 1.443 -0.808 0 O-C-N 123.484 0.49 . . . . 0.0 111.018 178.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 20.1 tp -62.73 -32.81 74.0 Favored 'General case' 0 CA--C 1.568 1.648 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.837 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . 0.447 HG12 ' HE ' ' A' ' 536' ' ' ARG . 24.1 mm -68.39 -41.39 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 174.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 19.5 m -55.35 -48.65 73.91 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.593 0.711 . . . . 0.0 109.597 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.487 ' HB3' ' NE ' ' A' ' 474' ' ' ARG . 7.8 mp -66.5 -19.69 65.85 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.112 178.07 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -87.89 -35.34 17.78 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 122.766 0.426 . . . . 0.0 111.927 175.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -69.46 -40.51 77.1 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.163 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -72.06 115.92 11.85 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 121.552 0.691 . . . . 0.0 111.591 173.944 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -98.31 93.67 6.34 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.607 -172.07 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 6.6 mp -83.0 -17.22 44.15 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.775 177.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -77.16 9.17 3.25 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -176.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -69.84 -21.99 63.32 Favored 'General case' 0 CA--C 1.495 -1.149 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 168.046 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -88.11 121.49 70.5 Favored Pre-proline 0 N--CA 1.411 -2.395 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.02 105.54 0.17 Allowed 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.151 1.901 . . . . 0.0 108.623 173.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . 0.589 ' O ' HG13 ' A' ' 556' ' ' ILE . 4.2 p90 -77.25 40.11 0.26 Allowed 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 -168.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.82 -48.04 64.56 Favored 'General case' 0 C--N 1.266 -3.046 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.603 -179.414 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -69.07 -27.22 65.43 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.736 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . 0.499 ' HB3' ' HB2' ' A' ' 552' ' ' TYR . 29.6 tt0 -68.85 -38.39 79.76 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.237 -177.238 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . 0.589 HG13 ' O ' ' A' ' 552' ' ' TYR . 62.5 mt -64.52 -45.57 95.26 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.332 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 176.149 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -59.57 -43.24 93.67 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 120.887 0.375 . . . . 0.0 110.686 178.249 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . 0.566 ' O ' HG21 ' A' ' 562' ' ' VAL . 27.5 t70 -62.54 -55.24 29.2 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.812 175.165 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.419 ' O ' HG12 ' A' ' 563' ' ' ILE . 40.6 t80 -48.28 -53.02 18.73 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 125.426 1.49 . . . . 0.0 110.759 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 48.6 t -55.99 -50.98 66.32 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.798 0 O-C-N 124.04 0.837 . . . . 0.0 109.524 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . 0.523 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 3.8 t-20 -57.95 -42.77 85.64 Favored 'General case' 0 C--O 1.193 -1.915 0 CA-C-N 117.788 0.267 . . . . 0.0 110.812 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . 0.566 HG21 ' O ' ' A' ' 558' ' ' ASP . 99.1 t -62.47 -36.39 74.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 C-N-CA 124.031 0.933 . . . . 0.0 112.403 -178.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.527 ' HA ' ' NE2' ' A' ' 469' ' ' GLN . 50.8 mm -88.08 -41.86 14.58 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.929 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 -173.666 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -85.38 18.02 2.88 Favored 'General case' 0 N--CA 1.423 -1.789 0 CA-C-N 112.946 -1.934 . . . . 0.0 110.274 -176.534 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.523 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 51.6 mt-10 -72.65 -16.05 61.71 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.199 -2.149 . . . . 0.0 105.199 165.846 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . 0.439 ' HZ3' ' CD ' ' A' ' 469' ' ' GLN . 59.8 mttp -95.45 25.71 4.29 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 113.444 -1.707 . . . . 0.0 109.942 174.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -137.61 -66.91 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 70.77 157.93 0.18 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.826 1.25 . . . . 0.0 113.938 176.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -69.18 104.99 2.33 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -173.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 5.4 t -165.72 -54.35 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 105.539 -2.023 . . . . 0.0 105.539 175.125 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 4.8 tp -93.01 -38.43 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.749 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 168.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 44.5 mm-40 -68.68 -13.1 62.15 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 114.179 -1.373 . . . . 0.0 112.924 -178.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 573' ' ' SER . . . . . 0.452 ' O ' ' HD2' ' A' ' 577' ' ' LYS . 15.2 p -64.33 -38.54 91.41 Favored 'General case' 0 N--CA 1.418 -2.039 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 175.821 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . 0.557 ' HA ' ' CG ' ' A' ' 602' ' ' LYS . 7.0 mp -62.3 -49.75 74.39 Favored 'General case' 0 CA--C 1.498 -1.043 0 CA-C-O 122.72 1.248 . . . . 0.0 110.605 176.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . 0.651 ' O ' ' HB3' ' A' ' 578' ' ' LEU . 54.0 t30 -62.96 -31.42 72.53 Favored 'General case' 0 C--N 1.247 -3.881 0 CA-C-N 113.186 -1.825 . . . . 0.0 111.131 178.546 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . 0.37 24.2 m170 -63.75 -31.82 73.12 Favored 'General case' 0 C--N 1.287 -2.14 0 O-C-N 120.157 -1.59 . . . . 0.0 112.507 168.63 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . 0.622 ' O ' ' HB3' ' A' ' 580' ' ' GLU . 0.9 OUTLIER -66.92 -24.72 66.12 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.447 0.641 . . . . 0.0 110.892 171.391 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . 0.651 ' HB3' ' O ' ' A' ' 575' ' ' ASN . 3.4 tm? -57.13 -45.81 83.21 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 168.137 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . 0.437 ' HB3' ' OE1' ' A' ' 588' ' ' GLU . 24.5 mtp85 -60.46 -29.2 68.89 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.693 0.759 . . . . 0.0 112.742 175.094 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . 0.622 ' HB3' ' O ' ' A' ' 577' ' ' LYS . 1.7 tm-20 -57.76 -42.79 84.72 Favored 'General case' 0 C--N 1.299 -1.625 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 174.534 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -65.45 -31.62 72.8 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-O 121.403 0.621 . . . . 0.0 111.701 171.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.549 ' C ' ' H ' ' A' ' 584' ' ' ILE . 23.8 m -61.74 -22.45 65.4 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 126.344 1.857 . . . . 0.0 112.582 178.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.456 ' HA ' ' HB2' ' A' ' 588' ' ' GLU . 12.6 ptp180 -41.44 7.86 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 115.906 1.817 . . . . 0.0 115.906 172.923 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . 0.549 ' H ' ' C ' ' A' ' 582' ' ' THR . 31.7 pt -77.52 12.89 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 124.909 1.284 . . . . 0.0 112.263 -178.03 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 129.92 6.53 4.01 Favored Glycine 0 N--CA 1.477 1.404 0 C-N-CA 119.469 -1.348 . . . . 0.0 115.242 171.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . 0.609 ' C ' ' H ' ' A' ' 588' ' ' GLU . 35.2 t0 -85.01 167.98 15.35 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 169.755 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.526 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 6.1 t -54.35 16.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.584 2.254 0 C-N-CA 128.636 2.774 . . . . 0.0 112.299 -176.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.609 ' H ' ' C ' ' A' ' 586' ' ' ASP . 24.0 mm-40 -65.29 6.16 0.31 Allowed 'General case' 0 C--N 1.27 -2.859 0 C-N-CA 126.361 1.864 . . . . 0.0 114.05 -175.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . 0.475 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 58.5 tp -76.92 -42.47 39.31 Favored 'General case' 0 C--O 1.265 1.909 0 N-CA-C 105.989 -1.856 . . . . 0.0 105.989 166.011 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . 0.526 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 35.6 tt0 -56.63 -49.42 75.04 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 112.986 -1.916 . . . . 0.0 107.765 173.531 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.414 ' HB2' ' HA ' ' A' ' 588' ' ' GLU . 0.2 OUTLIER -78.21 -17.64 56.49 Favored 'General case' 0 C--O 1.201 -1.46 0 CA-C-N 114.648 -1.16 . . . . 0.0 111.27 178.415 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.475 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 88.0 t80 -56.37 -44.52 80.25 Favored 'General case' 0 CA--C 1.478 -1.789 0 C-N-CA 123.604 0.761 . . . . 0.0 109.193 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . 0.543 ' O ' HD12 ' A' ' 597' ' ' ILE . 73.6 t80 -57.38 -51.47 69.26 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.463 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.5 -42.56 87.9 Favored 'General case' 0 C--O 1.251 1.155 0 CA-C-O 122.497 1.141 . . . . 0.0 111.575 -178.581 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . 0.474 HE21 ' C ' ' A' ' 595' ' ' GLN 0.301 0.0 OUTLIER -75.06 -42.62 56.54 Favored 'General case' 0 C--O 1.158 -3.726 0 CA-C-O 117.596 -1.192 . . . . 0.0 112.854 -177.073 . . . . . . . . 4 4 . 1 . 018 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -63.59 -47.87 79.7 Favored 'General case' 0 CA--C 1.495 -1.171 0 CA-C-N 119.31 0.959 . . . . 0.0 111.468 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . 0.543 HD12 ' O ' ' A' ' 593' ' ' TYR . 1.8 mp -57.19 -61.09 1.39 Allowed 'Isoleucine or valine' 0 C--O 1.27 2.181 0 CA-C-O 122.909 1.338 . . . . 0.0 110.193 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . 0.499 ' HB ' ' HZ3' ' A' ' 577' ' ' LYS . 45.3 t -72.1 -17.03 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.339 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.858 -175.843 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -63.0 -41.97 99.73 Favored 'General case' 0 CA--C 1.468 -2.206 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 175.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . 0.661 ' O ' ' HB2' ' A' ' 604' ' ' ARG . 87.7 tttt -61.14 -50.39 73.37 Favored 'General case' 0 N--CA 1.422 -1.867 0 O-C-N 124.527 1.142 . . . . 0.0 108.603 178.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -65.68 -40.96 92.91 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.557 ' CG ' ' HA ' ' A' ' 574' ' ' LEU . 4.4 tmtt? -67.03 -56.54 9.64 Favored 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 123.917 0.887 . . . . 0.0 108.812 -177.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -79.11 -2.92 42.94 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.032 -176.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . 0.661 ' HB2' ' O ' ' A' ' 600' ' ' LYS . 32.9 ttt180 -68.75 -12.12 61.09 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 123.526 0.73 . . . . 0.0 110.295 178.151 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 16.0 tpt . . . . . 0 C--N 1.306 -1.294 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 179.061 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 18.6 p90 . . . . . 0 N--CA 1.412 -2.336 0 CA-C-O 122.027 0.918 . . . . 0.0 110.565 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.76 79.57 1.78 Allowed 'General case' 0 C--N 1.278 -2.5 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 174.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -127.97 56.71 1.58 Allowed 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.579 -177.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 84.0 mt -72.44 91.06 1.34 Allowed 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 170.369 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 12.9 m -60.75 176.65 0.37 Allowed 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -170.403 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -54.73 -17.63 3.69 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.684 1.993 . . . . 0.0 113.214 -175.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -53.07 -44.84 67.8 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 123.188 0.305 . . . . 0.0 110.986 177.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . 0.5 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 38.1 tt0 -66.31 -30.76 71.24 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 119.511 -0.876 . . . . 0.0 111.046 -178.523 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . 0.417 ' HD3' HH21 ' A' ' 474' ' ' ARG . 27.8 tptp -64.62 -33.01 74.93 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.591 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -67.8 -44.86 76.37 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . 0.427 ' HB3' ' CE2' ' A' ' 504' ' ' PHE . 1.4 mp0 -56.64 -46.16 81.16 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.074 0.464 . . . . 0.0 110.529 172.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.5 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 37.7 mtm-85 -62.81 -37.7 87.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.384 -179.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . 0.641 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -72.13 -39.2 69.0 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 120.87 0.367 . . . . 0.0 110.927 176.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -63.56 -39.51 94.59 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-O 121.682 0.753 . . . . 0.0 110.797 -179.061 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 25.2 tp -71.78 -17.44 62.18 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.788 -1.096 . . . . 0.0 113.67 -173.904 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.641 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 19.5 pttp -70.78 -11.11 60.75 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -177.009 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -122.93 90.79 3.36 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . 0.497 ' HA ' ' HB2' ' A' ' 483' ' ' ASP . 4.2 tt -143.02 71.22 1.33 Allowed 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.781 0.8 . . . . 0.0 109.266 177.666 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 65.0 mtt -97.15 -88.73 0.29 Allowed 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.561 177.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -72.31 -9.06 58.0 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.276 1.431 . . . . 0.0 109.616 174.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.549 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 5.5 m-20 -69.18 37.48 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 128.411 2.685 . . . . 0.0 116.136 -166.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -53.41 -40.13 64.86 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 121.704 0.764 . . . . 0.0 109.983 172.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -60.0 -49.77 76.38 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.681 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 486' ' ' THR . . . . . 0.549 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 7.1 m -59.95 -42.18 93.47 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.101 0.96 . . . . 0.0 110.773 -178.866 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -54.79 -51.32 66.12 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 81.1 mt -68.68 -29.7 68.2 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.4 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -68.97 -34.26 75.02 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.778 0.323 . . . . 0.0 111.134 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -85.27 -40.14 16.93 Favored 'General case' 0 N--CA 1.419 -2.014 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -67.8 -35.15 78.13 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -77.48 -21.9 52.13 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 120.871 0.367 . . . . 0.0 110.525 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 64.5 m -83.8 -8.6 59.19 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.32 0.581 . . . . 0.0 111.76 -175.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . 0.405 HG23 ' OD1' ' A' ' 498' ' ' ASN . 0.3 OUTLIER -92.97 153.44 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.638 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -176.642 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -155.26 -105.69 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -172.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . 0.47 ' C ' ' H ' ' A' ' 498' ' ' ASN . 38.8 ttpt -90.3 -37.88 13.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.453 0.644 . . . . 0.0 110.533 178.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . 0.472 ' C ' ' H ' ' A' ' 499' ' ' PHE . 20.0 t0 -75.28 30.84 0.1 Allowed 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 126.04 1.736 . . . . 0.0 112.322 -174.138 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . 0.47 ' H ' ' C ' ' A' ' 496' ' ' LYS . 6.0 m-20 -73.14 36.11 0.08 Allowed 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 126.779 2.032 . . . . 0.0 111.355 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . 0.472 ' H ' ' C ' ' A' ' 497' ' ' ASP . 8.3 p90 -65.79 -13.06 58.72 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.258 -178.97 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 15.9 m -55.15 149.84 11.73 Favored 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 124.418 1.087 . . . . 0.0 108.743 173.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.469 ' C ' ' H ' ' A' ' 503' ' ' HIS . 49.8 m-80 -65.58 155.23 36.42 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.615 -0.678 . . . . 0.0 112.032 -174.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -66.64 5.92 0.54 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.135 0.493 . . . . 0.0 111.894 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . 0.473 ' O ' HG22 ' A' ' 507' ' ' VAL . 1.5 m-70 -54.51 -51.78 64.04 Favored 'General case' 0 C--O 1.203 -1.353 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 172.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . 0.427 ' CE2' ' HB3' ' A' ' 473' ' ' GLU . 94.2 m-85 -65.15 -27.3 68.63 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.967 -1.015 . . . . 0.0 113.182 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -68.14 -44.23 76.5 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -38.5 89.13 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 119.787 -0.765 . . . . 0.0 109.677 177.806 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . 0.473 HG22 ' O ' ' A' ' 503' ' ' HIS . 22.1 t -62.18 -47.11 94.66 Favored 'Isoleucine or valine' 0 C--N 1.354 0.778 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -47.78 -45.72 29.67 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.697 0.799 . . . . 0.0 111.235 173.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -60.05 -53.19 60.71 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.445 -179.253 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 18.5 t -58.87 -48.1 87.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 123.406 0.442 . . . . 0.0 109.945 178.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 97.1 mt -54.46 -56.53 17.78 Favored 'General case' 0 C--O 1.211 -0.971 0 O-C-N 124.067 0.854 . . . . 0.0 110.545 -178.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -60.3 -30.96 69.83 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 123.996 0.918 . . . . 0.0 110.774 -177.548 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.49 -46.66 66.09 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.597 -178.194 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . 0.251 11.2 p90 -82.83 -28.61 30.05 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 119.399 -0.92 . . . . 0.0 111.049 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -51.71 -35.67 43.9 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.802 1.241 . . . . 0.0 108.779 174.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -59.47 -28.83 67.35 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.036 -0.983 . . . . 0.0 111.234 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -103.36 -59.57 1.69 Allowed 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.485 179.222 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -157.38 122.18 4.43 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.279 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -90.87 96.95 10.89 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -174.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -142.27 124.23 15.29 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 161.583 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -67.97 129.24 39.31 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 119.45 1.023 . . . . 0.0 110.497 179.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -113.35 132.24 55.66 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.405 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 35.4 pt -78.47 -13.03 13.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.186 0 CA-C-O 121.17 0.51 . . . . 0.0 110.484 -177.75 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 524' ' ' SER . . . . . 0.55 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 33.1 t -58.17 -41.01 82.92 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.373 174.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -65.55 -35.86 82.08 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 108.901 -0.778 . . . . 0.0 108.901 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -60.71 -50.32 73.94 Favored 'General case' 0 C--O 1.213 -0.833 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.311 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 11.9 p -71.17 -18.02 20.27 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.868 -0.52 . . . . 0.0 111.006 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . 0.55 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.4 mm100 -68.04 -39.78 83.0 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 170.947 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.508 ' CB ' ' HG3' ' A' ' 536' ' ' ARG . 8.1 m-85 -72.36 13.9 0.29 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.146 1.378 . . . . 0.0 112.894 176.596 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.77 ' HA ' ' NH2' ' A' ' 536' ' ' ARG . 8.7 p -72.74 18.4 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.592 2.585 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.453 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -129.16 -49.27 1.2 Allowed 'General case' 0 N--CA 1.479 0.991 0 O-C-N 120.953 -1.092 . . . . 0.0 109.714 176.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 532' ' ' SER . . . . . 0.429 ' C ' ' H ' ' A' ' 534' ' ' GLU . 27.4 t -76.04 -144.42 0.02 OUTLIER 'General case' 0 CA--C 1.578 2.036 0 C-N-CA 126.806 2.042 . . . . 0.0 112.349 -176.02 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . 0.583 ' C ' ' H ' ' A' ' 535' ' ' LEU . 2.0 t-20 -28.45 30.42 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.978 1 C-N-CA 138.831 6.853 . . . . 0.0 117.419 179.072 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . 0.429 ' H ' ' C ' ' A' ' 532' ' ' SER . 12.6 pt-20 -32.32 9.92 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.221 1 C-N-CA 131.762 4.025 . . . . 0.0 116.891 179.706 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.583 ' H ' ' C ' ' A' ' 533' ' ' ASN . 40.9 mt -63.51 -29.36 70.64 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 102.474 -3.158 . . . . 0.0 102.474 162.051 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . 0.77 ' NH2' ' HA ' ' A' ' 530' ' ' VAL . 0.4 OUTLIER -54.27 -36.92 64.13 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 111.897 -2.411 . . . . 0.0 110.279 170.617 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -72.22 -37.24 69.24 Favored 'General case' 0 CA--C 1.483 -1.611 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -175.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 5.9 m -59.64 -40.98 89.44 Favored 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 118.837 -1.145 . . . . 0.0 108.965 170.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 63.8 tp -59.99 -34.51 73.42 Favored 'General case' 0 C--O 1.215 -0.734 0 O-C-N 121.619 -0.676 . . . . 0.0 111.676 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 53.0 mt -61.97 -35.12 66.49 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.261 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 5.5 p -58.3 -43.96 88.34 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 8.2 mp -64.78 -41.15 96.07 Favored 'General case' 0 N--CA 1.487 1.42 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.175 176.653 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -61.97 -35.42 78.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.173 0.989 . . . . 0.0 108.85 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . 0.567 ' HG2' ' O ' ' A' ' 544' ' ' GLN . 53.4 tt0 -74.05 39.97 0.12 Allowed 'General case' 0 CA--C 1.567 1.606 0 CA-C-O 122.656 1.217 . . . . 0.0 111.209 177.066 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -75.05 157.08 35.41 Favored 'General case' 0 C--N 1.279 -2.47 0 O-C-N 120.949 -1.095 . . . . 0.0 111.086 177.122 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -102.73 -178.01 3.55 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.717 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . 0.599 ' O ' ' HG3' ' A' ' 550' ' ' GLU . 92.2 mt -76.27 18.96 0.26 Allowed 'General case' 0 C--O 1.208 -1.111 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -173.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . 0.484 ' O ' ' HD2' ' A' ' 552' ' ' TYR . 31.3 p-10 -75.02 -8.5 56.71 Favored 'General case' 0 C--N 1.317 -0.836 0 O-C-N 121.934 -0.479 . . . . 0.0 110.974 179.587 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -70.15 0.86 5.45 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.927 0.891 . . . . 0.0 112.35 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . 0.599 ' HG3' ' O ' ' A' ' 547' ' ' LEU . 45.8 mt-10 -55.08 133.35 68.29 Favored Pre-proline 0 C--O 1.239 0.544 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_exo 5.16 61.01 0.0 OUTLIER 'Trans proline' 0 C--N 1.376 1.994 1 C-N-CA 126.843 5.029 . . . . 0.0 115.878 -166.496 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . 0.601 ' O ' ' HG3' ' A' ' 555' ' ' GLU . 1.6 t80 -99.83 21.17 12.94 Favored 'General case' 0 C--O 1.205 -1.248 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 -175.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -68.35 11.1 0.18 Allowed 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -174.806 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . 0.552 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 6.9 t30 -75.18 -20.6 59.23 Favored 'General case' 0 C--O 1.17 -3.098 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 171.184 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . 0.601 ' HG3' ' O ' ' A' ' 552' ' ' TYR . 51.3 mt-10 -35.49 -46.04 0.37 Allowed 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 114.517 1.302 . . . . 0.0 114.517 -176.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 59.5 mt -58.78 -38.48 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 CA-C-N 118.28 0.491 . . . . 0.0 110.714 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . 0.552 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 3.4 t70 -59.54 -54.59 44.76 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.984 0.914 . . . . 0.0 108.808 176.781 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . 0.61 ' O ' HG22 ' A' ' 562' ' ' VAL . 12.8 m-20 -58.52 -53.92 52.83 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.006 177.71 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.538 ' O ' HD11 ' A' ' 563' ' ' ILE . 63.3 t80 -51.86 -53.28 42.27 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 126.815 2.046 . . . . 0.0 111.881 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 49.3 t -59.84 -41.39 85.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . 0.593 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 8.0 t30 -60.89 -59.73 4.92 Favored 'General case' 0 C--O 1.193 -1.906 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.558 175.227 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . 0.61 HG22 ' O ' ' A' ' 558' ' ' ASP . 60.1 t -55.07 -36.98 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 C-N-CA 124.074 0.949 . . . . 0.0 112.714 -172.753 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.538 HD11 ' O ' ' A' ' 559' ' ' TYR . 1.6 mp -80.15 -40.61 20.35 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.544 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.917 -172.419 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -95.45 7.09 47.25 Favored 'General case' 0 N--CA 1.416 -2.167 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.869 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.593 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 52.5 mt-10 -71.67 -23.68 61.71 Favored 'General case' 0 C--N 1.368 1.391 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 170.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -70.45 56.61 0.17 Allowed 'General case' 0 CA--C 1.557 1.224 0 CA-C-N 113.902 -1.499 . . . . 0.0 114.324 -176.453 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -131.04 -114.66 1.66 Allowed Glycine 0 N--CA 1.435 -1.375 0 N-CA-C 108.113 -1.995 . . . . 0.0 108.113 173.61 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . 0.433 ' C ' ' H ' ' A' ' 570' ' ' THR . 57.4 tp60 -153.8 -78.94 0.1 Allowed 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 173.066 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -87.06 32.33 0.69 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 177.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 570' ' ' THR . . . . . 0.433 ' H ' ' C ' ' A' ' 568' ' ' GLN . 9.7 m -107.07 -14.76 14.85 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.014 -167.215 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . 0.497 ' O ' ' HB2' ' A' ' 574' ' ' LEU . 6.3 mt -79.83 -37.26 17.92 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.748 0 CA-C-O 121.861 0.839 . . . . 0.0 110.355 -168.741 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . 0.471 ' OE1' ' HD2' ' A' ' 604' ' ' ARG . 41.7 mt-10 -83.02 -25.07 32.52 Favored 'General case' 0 N--CA 1.405 -2.711 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.944 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 19.3 m -65.36 -28.97 69.66 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 174.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' A' ' 571' ' ' ILE . 82.1 mt -57.69 -37.5 73.57 Favored 'General case' 0 C--O 1.196 -1.724 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.217 174.584 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 -57.14 -48.87 77.62 Favored 'General case' 0 C--O 1.244 0.787 0 O-C-N 123.675 0.609 . . . . 0.0 110.319 -178.667 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 11.4 t60 -64.53 -47.17 79.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.551 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -66.47 -40.51 89.39 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.57 -49.13 78.58 Favored 'General case' 0 CA--C 1.501 -0.913 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.704 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -42.61 89.96 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 124.203 0.939 . . . . 0.0 110.051 179.733 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -69.96 -41.92 73.85 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 116.277 -0.42 . . . . 0.0 112.032 -176.192 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -60.2 -50.5 73.42 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.521 0.676 . . . . 0.0 111.522 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 582' ' ' THR . . . . . 0.479 ' HB ' ' HB3' ' A' ' 586' ' ' ASP . 22.6 p -72.89 -24.83 60.89 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -176.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . . . . . . . . . 53.7 ttt180 -44.01 -9.16 0.01 OUTLIER 'General case' 0 CA--C 1.577 1.993 0 C-N-CA 126.496 1.919 . . . . 0.0 115.269 -178.979 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 37.8 pt -77.03 10.3 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.308 0 C-N-CA 123.833 0.853 . . . . 0.0 112.724 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 126.82 14.2 2.86 Favored Glycine 0 N--CA 1.469 0.878 0 C-N-CA 120.35 -0.928 . . . . 0.0 113.673 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . 0.479 ' HB3' ' HB ' ' A' ' 582' ' ' THR . 34.8 t70 -82.59 167.93 17.82 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 124.259 1.024 . . . . 0.0 111.971 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.6 p -41.91 21.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.594 2.652 1 C-N-CA 131.933 4.093 . . . . 0.0 115.74 177.575 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.479 ' H ' ' C ' ' A' ' 586' ' ' ASP . 43.0 mm-40 -43.52 -8.34 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 129.06 2.944 . . . . 0.0 116.398 -175.123 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . 0.409 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 60.2 mt -69.67 -56.55 6.94 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 167.157 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 55.5 tp60 -53.73 -42.44 68.12 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.433 172.281 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.542 ' HZ3' ' HB2' ' A' ' 591' ' ' LYS . 2.2 ttmp? -80.78 -15.75 55.61 Favored 'General case' 0 C--O 1.197 -1.665 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.606 -178.536 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.409 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 72.7 t80 -59.82 -39.87 86.54 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 173.299 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -56.16 -46.81 79.17 Favored 'General case' 0 CA--C 1.562 1.419 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.696 174.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . 0.427 HD22 ' HG3' ' A' ' 591' ' ' LYS . 9.2 mp -63.75 -33.45 75.69 Favored 'General case' 0 C--O 1.212 -0.879 0 CA-C-O 121.227 0.537 . . . . 0.0 111.107 174.623 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . 0.463 ' HA ' ' CG2' ' A' ' 598' ' ' VAL . 29.4 tt0 -65.96 -27.53 68.23 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 123.289 0.636 . . . . 0.0 110.557 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -68.21 -41.58 81.1 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 171.626 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 54.4 mt -59.33 -34.2 53.38 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.738 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.921 173.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . 0.463 ' CG2' ' HA ' ' A' ' 595' ' ' GLN . 57.8 t -62.24 -36.74 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 174.492 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . 0.512 ' O ' ' HB3' ' A' ' 602' ' ' LYS . . . -63.44 -33.5 75.69 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.263 177.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -67.18 -38.71 85.84 Favored 'General case' 0 C--O 1.251 1.134 0 CA-C-O 121.633 0.73 . . . . 0.0 109.093 174.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 15.3 t-20 -62.12 -33.38 74.35 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.593 174.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . 0.512 ' HB3' ' O ' ' A' ' 599' ' ' ALA . 19.4 ttpt -65.13 -46.33 81.41 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.553 173.597 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . 0.495 ' C ' ' H ' ' A' ' 605' ' ' MET . 44.9 mt-10 -74.07 -1.92 22.17 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -176.37 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . 0.471 ' HD2' ' OE1' ' A' ' 572' ' ' GLU . 47.5 mtp180 -67.82 19.93 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 123.653 0.781 . . . . 0.0 112.156 171.003 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 605' ' ' MET . . . . . 0.495 ' H ' ' C ' ' A' ' 603' ' ' GLU . 56.1 ttp . . . . . 0 C--N 1.296 -1.754 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 -179.483 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 N--CA 1.434 -1.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -130.65 79.55 1.9 Allowed 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 177.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -124.65 46.04 2.4 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.403 -177.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 92.2 mt -73.07 103.32 3.79 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.916 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 39.7 m -101.76 127.86 48.35 Favored 'General case' 0 C--N 1.278 -2.502 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 88.4 mtm180 -62.74 -12.77 26.11 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -177.77 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 469' ' ' GLN . . . . . 0.471 ' O ' ' HG3' ' A' ' 473' ' ' GLU . 24.6 mt-30 -40.99 -49.55 3.29 Favored 'General case' 0 C--O 1.206 -1.185 0 C-N-CA 125.479 1.511 . . . . 0.0 114.156 -177.789 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -68.74 -31.81 71.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.953 0.406 . . . . 0.0 111.039 -174.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 22.8 tptp -74.76 -29.81 61.26 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 472' ' ' ALA . . . . . 0.467 ' HB1' ' CD1' ' A' ' 559' ' ' TYR . . . -69.82 -47.92 60.97 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 174.417 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . 0.476 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 57.7 mt-10 -49.81 -49.57 48.32 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.64 0.776 . . . . 0.0 109.488 173.687 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 474' ' ' ARG . . . . . 0.515 ' HG3' ' CD2' ' A' ' 542' ' ' LEU . 11.1 tpp85 -46.79 -60.89 2.12 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 125.261 1.424 . . . . 0.0 109.657 -178.277 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 475' ' ' ALA . . . . . 0.543 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -68.53 -36.01 78.26 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-N 115.289 -0.868 . . . . 0.0 112.445 -177.132 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -33.54 74.69 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.332 0.586 . . . . 0.0 112.079 -177.218 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 477' ' ' LEU . . . . . 0.476 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 94.0 mt -73.47 -8.84 57.57 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -176.775 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 478' ' ' LYS . . . . . 0.543 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 63.3 pttt -76.5 6.38 5.86 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.917 -0.49 . . . . 0.0 110.993 -178.133 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 10.4 t-80 -77.75 23.94 0.23 Allowed 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 123.741 0.816 . . . . 0.0 112.729 -172.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . 0.29 2.7 pp 49.76 -158.8 0.07 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.629 1.572 . . . . 0.0 114.798 177.165 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 481' ' ' MET . . . . . 0.479 ' C ' ' H ' ' A' ' 483' ' ' ASP . 46.9 ttm -66.7 6.95 0.41 Allowed 'General case' 0 CA--C 1.569 1.695 0 CA-C-O 122.569 1.175 . . . . 0.0 113.648 -174.659 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 26.7 mmt180 -74.69 11.1 1.12 Allowed 'General case' 0 C--O 1.248 0.998 0 C-N-CA 123.899 0.88 . . . . 0.0 110.153 167.102 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 483' ' ' ASP . . . . . 0.479 ' H ' ' C ' ' A' ' 481' ' ' MET . 9.5 p-10 -68.81 1.0 3.65 Favored 'General case' 0 C--O 1.201 -1.478 0 C-N-CA 126.231 1.812 . . . . 0.0 113.608 -169.304 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -72.28 -60.37 2.26 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.54 -53.52 56.59 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.544 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 86.1 m -59.44 -37.97 79.49 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.786 -178.716 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 46.7 t80 -56.15 -58.02 9.73 Favored 'General case' 0 C--O 1.205 -1.269 0 C-N-CA 120.419 -0.513 . . . . 0.0 110.158 179.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 5.9 mp -72.29 -31.91 66.13 Favored 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 119.454 -0.898 . . . . 0.0 111.364 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -68.26 -41.06 81.67 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.932 0.396 . . . . 0.0 111.32 -177.196 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -85.28 -35.41 21.53 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.546 -178.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -58.26 -46.36 86.15 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 122.873 0.469 . . . . 0.0 112.259 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -81.65 -15.58 54.12 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -177.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 73.4 m -80.98 -28.42 35.56 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -178.293 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 11.8 t -98.52 152.3 4.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -152.23 -39.58 0.11 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.693 0.759 . . . . 0.0 110.27 -178.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -82.44 18.7 1.4 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.938 178.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 497' ' ' ASP . . . . . 0.729 ' O ' ' HB3' ' A' ' 501' ' ' ASN . 7.6 p-10 -65.93 -19.51 65.89 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 123.837 0.855 . . . . 0.0 110.78 -178.99 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . 0.458 ' HA ' ' ND2' ' A' ' 501' ' ' ASN . 6.9 t-20 -72.88 15.45 0.2 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.751 1.22 . . . . 0.0 114.023 -165.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -75.65 -71.95 0.34 Allowed 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 26.0 m -127.36 93.36 3.71 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 170.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 501' ' ' ASN . . . . . 0.729 ' HB3' ' O ' ' A' ' 497' ' ' ASP . 34.8 p-10 -127.14 46.33 2.54 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -169.127 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 18.3 pm0 -73.17 -25.29 60.74 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.319 -0.952 . . . . 0.0 108.485 173.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 503' ' ' HIS . . . . . 0.418 ' O ' HG22 ' A' ' 507' ' ' VAL . 38.3 t-80 -62.64 -64.49 0.9 Allowed 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.218 175.888 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -55.74 -38.48 69.85 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 124.025 0.93 . . . . 0.0 110.639 -179.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -64.88 -52.02 58.82 Favored 'General case' 0 CA--C 1.5 -0.943 0 C-N-CA 123.079 0.552 . . . . 0.0 109.595 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -62.61 -41.67 99.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 507' ' ' VAL . . . . . 0.418 HG22 ' O ' ' A' ' 503' ' ' HIS . 67.0 t -62.36 -52.96 53.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.714 178.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -49.64 -53.06 26.41 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 124.534 1.146 . . . . 0.0 111.838 176.031 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -56.79 -62.63 1.6 Allowed 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.321 0.648 . . . . 0.0 112.185 -177.312 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 48.6 t -59.69 -45.85 93.98 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.665 0 O-C-N 123.692 0.62 . . . . 0.0 110.944 -176.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 3.2 tt -69.23 -49.08 59.66 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.955 -172.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -67.76 -29.52 68.75 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.185 -176.228 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -64.43 -49.23 72.33 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.244 0.545 . . . . 0.0 110.434 178.707 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -70.48 -55.25 9.4 Favored 'General case' 0 C--O 1.198 -1.627 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.232 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -52.67 -36.32 56.74 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -178.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -77.6 -19.38 55.67 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.34 -45.6 2.92 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 122.111 0.958 . . . . 0.0 110.018 -172.792 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 39.0 t-20 -112.38 -154.34 0.54 Allowed 'General case' 0 C--N 1.286 -2.169 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 9.1 m-20 -83.82 -160.24 0.43 Allowed 'General case' 0 C--N 1.308 -1.221 0 C-N-CA 123.468 0.707 . . . . 0.0 109.878 177.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 520' ' ' GLN . . . . . 0.474 ' H ' ' NE2' ' A' ' 520' ' ' GLN . 0.0 OUTLIER -62.62 177.12 0.56 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.617 0.767 . . . . 0.0 110.257 178.265 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -88.11 148.81 24.27 Favored 'General case' 1 N--CA 1.37 -4.449 0 O-C-N 121.543 -0.723 . . . . 0.0 109.638 -175.242 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 522' ' ' ASN . . . . . 0.482 ' HB3' ' OD2' ' A' ' 525' ' ' ASP . 52.0 t30 -116.11 154.64 29.6 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.466 0.65 . . . . 0.0 111.313 -174.634 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -37.21 78.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 C-N-CA 124.776 1.23 . . . . 0.0 110.7 -178.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 39.0 t -57.1 -33.01 66.88 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.956 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 525' ' ' ASP . . . . . 0.482 ' OD2' ' HB3' ' A' ' 522' ' ' ASN . 12.0 m-20 -61.1 -40.69 94.7 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.303 0.573 . . . . 0.0 110.0 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 526' ' ' ALA . . . . . 0.433 ' HA ' ' HD3' ' A' ' 536' ' ' ARG . . . -63.57 -43.17 97.79 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.243 178.019 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 527' ' ' VAL . . . . . 0.504 ' O ' HG21 ' A' ' 530' ' ' VAL . 96.9 t -64.63 -35.34 74.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 C-N-CA 125.033 1.333 . . . . 0.0 110.805 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -66.74 -34.63 78.26 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.43 0.634 . . . . 0.0 109.595 175.4 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.51 ' HB3' ' HD2' ' A' ' 536' ' ' ARG . 1.1 t80 -77.28 2.62 15.11 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 -178.735 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 530' ' ' VAL . . . . . 0.504 HG21 ' O ' ' A' ' 527' ' ' VAL . 14.7 m -74.69 15.0 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -176.174 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -109.03 -36.22 6.13 Favored 'General case' 0 C--N 1.285 -2.228 0 C-N-CA 119.458 -0.897 . . . . 0.0 108.644 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 532' ' ' SER . . . . . 0.557 ' C ' ' H ' ' A' ' 534' ' ' GLU . 26.3 t -81.44 -143.16 0.05 OUTLIER 'General case' 0 C--N 1.29 -2.019 0 C-N-CA 125.63 1.572 . . . . 0.0 107.673 173.234 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 533' ' ' ASN . . . . . 0.571 ' C ' ' H ' ' A' ' 535' ' ' LEU 0.386 17.2 m120 -35.14 29.08 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.986 1 C-N-CA 132.926 4.49 . . . . 0.0 118.764 171.607 . . . . . . . . 4 3 . 1 . 020 nuclear orig full ' A' A ' 534' ' ' GLU . . . . . 0.557 ' H ' ' C ' ' A' ' 532' ' ' SER . 9.6 pt-20 -34.63 8.04 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 130.515 3.526 . . . . 0.0 116.008 177.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 535' ' ' LEU . . . . . 0.571 ' H ' ' C ' ' A' ' 533' ' ' ASN . 3.3 pp -67.77 -21.36 65.26 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 162.179 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 536' ' ' ARG . . . . . 0.51 ' HD2' ' HB3' ' A' ' 529' ' ' TYR . 28.0 ttm-85 -66.56 -24.86 66.42 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.676 -1.602 . . . . 0.0 110.445 171.191 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 2.4 tm-20 -75.34 -39.2 59.63 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.803 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 538' ' ' THR . . . . . 0.431 ' O ' ' HB2' ' A' ' 541' ' ' SER . 8.9 m -57.7 -42.23 83.29 Favored 'General case' 0 CA--C 1.563 1.48 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.45 173.61 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.07 -43.09 91.71 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.031 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 540' ' ' ILE . . . . . 0.52 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 75.2 mt -57.29 -40.51 74.35 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.256 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 541' ' ' SER . . . . . 0.431 ' HB2' ' O ' ' A' ' 538' ' ' THR . 26.4 m -56.31 -38.79 71.75 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 120.934 0.397 . . . . 0.0 111.339 177.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 542' ' ' LEU . . . . . 0.555 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 8.3 mp -69.59 -24.8 63.73 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 120.801 0.334 . . . . 0.0 111.644 174.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -75.44 -38.64 59.6 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 544' ' ' GLN . . . . . 0.52 ' HG2' ' O ' ' A' ' 540' ' ' ILE . 74.7 mm-40 -79.5 33.63 0.25 Allowed 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 125.763 1.625 . . . . 0.0 110.481 177.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 545' ' ' TYR . . . . . 0.555 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 8.6 p90 -65.12 154.49 37.76 Favored 'General case' 0 N--CA 1.404 -2.77 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -169.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 546' ' ' ASN . . . . . 0.431 ' C ' ' H ' ' A' ' 548' ' ' ASN . 15.4 t-20 -83.6 -176.19 6.18 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.497 -1.228 . . . . 0.0 109.017 -174.342 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 547' ' ' LEU . . . . . 0.458 ' C ' ' H ' ' A' ' 549' ' ' ASP . 2.2 pp -69.45 17.54 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -174.927 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 548' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 546' ' ' ASN . 15.8 m120 -73.96 22.43 0.09 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.251 1.821 . . . . 0.0 111.782 177.795 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 549' ' ' ASP . . . . . 0.458 ' H ' ' C ' ' A' ' 547' ' ' LEU . 28.5 t70 -72.12 -6.79 45.05 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 124.008 0.923 . . . . 0.0 112.19 -177.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -59.43 158.91 18.6 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-O 119.313 -0.375 . . . . 0.0 110.266 -177.629 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 20.0 Cg_endo -59.7 72.99 0.06 OUTLIER 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 122.86 2.373 . . . . 0.0 115.105 -179.088 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -100.67 9.7 42.11 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 173.658 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.35 14.2 0.1 Allowed 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 113.408 -1.724 . . . . 0.0 113.934 -174.47 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 554' ' ' ASN . . . . . 0.544 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 3.9 t30 -68.5 -19.98 64.56 Favored 'General case' 0 C--O 1.192 -1.953 0 N-CA-C 104.12 -2.548 . . . . 0.0 104.12 165.729 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -33.46 -42.06 0.09 Allowed 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 127.528 2.331 . . . . 0.0 111.783 168.587 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 21.9 mm -62.02 -44.3 98.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 109.425 -0.584 . . . . 0.0 109.425 177.468 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 557' ' ' ASP . . . . . 0.544 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 6.4 t70 -58.64 -44.11 89.96 Favored 'General case' 0 C--O 1.25 1.112 0 C-N-CA 124.261 1.024 . . . . 0.0 110.443 176.625 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -68.91 -49.21 60.08 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.325 177.309 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 559' ' ' TYR . . . . . 0.467 ' CD1' ' HB1' ' A' ' 472' ' ' ALA . 48.4 t80 -50.25 -52.06 39.38 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.164 1.386 . . . . 0.0 111.356 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 48.4 t -62.96 -39.18 84.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.213 -179.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -61.45 -36.5 80.58 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-O 120.705 0.288 . . . . 0.0 110.514 175.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 562' ' ' VAL . . . . . 0.516 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 54.0 t -70.63 -33.75 54.3 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.05 0 C-N-CA 123.863 0.865 . . . . 0.0 112.905 177.692 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 563' ' ' ILE . . . . . 0.425 HG12 ' O ' ' A' ' 559' ' ' TYR . 49.1 mm -84.17 -40.1 15.25 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.717 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 -176.965 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -79.39 -2.97 44.17 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 114.449 -1.25 . . . . 0.0 110.164 178.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 565' ' ' GLU . . . . . 0.516 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 19.1 tt0 -56.55 -35.08 67.73 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 170.201 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 19.9 mmtp -117.44 20.36 13.61 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 113.927 -1.488 . . . . 0.0 109.885 179.065 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -102.75 -121.17 4.87 Favored Glycine 0 N--CA 1.432 -1.61 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.674 -176.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -145.8 -92.01 0.09 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -176.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -65.14 117.33 7.58 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 123.425 0.69 . . . . 0.0 110.968 -173.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 570' ' ' THR . . . . . 0.618 ' O ' ' HG ' ' A' ' 574' ' ' LEU . 88.1 m -104.56 -77.41 0.58 Allowed 'General case' 0 N--CA 1.423 -1.803 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -171.873 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.3 tt -53.14 -51.36 39.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 -163.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -79.44 -26.62 41.76 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.727 -0.789 . . . . 0.0 111.583 -175.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 20.9 m -65.82 -35.66 81.31 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 176.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 574' ' ' LEU . . . . . 0.618 ' HG ' ' O ' ' A' ' 570' ' ' THR . 60.9 mt -61.18 -51.9 67.09 Favored 'General case' 0 C--O 1.208 -1.118 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.124 175.087 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -58.36 -41.21 84.21 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 120.931 0.396 . . . . 0.0 111.985 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -61.15 -47.74 84.85 Favored 'General case' 0 C--O 1.249 1.067 0 CA-C-O 121.631 0.729 . . . . 0.0 109.995 175.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 577' ' ' LYS . . . . . 0.511 ' HA ' ' HE3' ' A' ' 577' ' ' LYS . 0.7 OUTLIER -67.54 -42.71 82.28 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.066 -177.749 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 54.4 tp -55.41 -48.12 74.87 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 123.943 0.897 . . . . 0.0 111.797 -179.364 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 579' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -62.66 -39.64 94.55 Favored 'General case' 0 C--O 1.251 1.177 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.926 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 580' ' ' GLU . . . . . 0.685 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 31.9 tt0 -68.63 -33.59 74.28 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 121.007 0.432 . . . . 0.0 109.951 177.39 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 581' ' ' ALA . . . . . 0.483 ' O ' HG12 ' A' ' 584' ' ' ILE . . . -61.29 -48.91 79.22 Favored 'General case' 0 C--O 1.183 -2.433 0 C-N-CA 122.568 0.347 . . . . 0.0 110.319 174.573 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 582' ' ' THR . . . . . . . . . . . . . 32.7 p -60.63 -24.89 65.88 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 583' ' ' ARG . . . . . 0.685 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 60.0 ttt180 -53.87 -6.39 0.09 Allowed 'General case' 0 CA--C 1.601 2.927 0 C-N-CA 123.896 0.878 . . . . 0.0 112.275 169.361 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 584' ' ' ILE . . . . . 0.483 HG12 ' O ' ' A' ' 581' ' ' ALA . 31.8 pt -72.05 41.23 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.401 0 C-N-CA 124.524 1.13 . . . . 0.0 113.399 177.615 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 585' ' ' GLY . . . . . 0.406 ' H ' ' C ' ' A' ' 583' ' ' ARG . . . 131.04 -55.45 0.77 Allowed Glycine 0 C--N 1.281 -2.501 0 CA-C-O 119.035 -0.87 . . . . 0.0 114.831 169.639 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -87.67 75.44 9.01 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 119.42 1.61 . . . . 0.0 109.204 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 587' ' ' VAL . . . . . 0.541 ' O ' ' HB3' ' A' ' 591' ' ' LYS . 59.6 t -64.69 -67.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.164 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.532 -177.771 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 588' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 592' ' ' TYR . 0.0 OUTLIER -61.55 -47.55 85.03 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -177.368 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 9.9 tt -70.39 -66.13 0.64 Allowed 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -174.689 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -60.91 -42.48 98.15 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -175.139 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 591' ' ' LYS . . . . . 0.541 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 58.7 tttm -65.7 -37.13 85.59 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-O 119.62 -0.229 . . . . 0.0 110.864 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 592' ' ' TYR . . . . . 0.474 ' HB2' ' O ' ' A' ' 588' ' ' GLU . 58.1 t80 -57.02 -51.67 68.33 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.464 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 593' ' ' TYR . . . . . 0.489 ' O ' HG13 ' A' ' 597' ' ' ILE . 56.2 m-85 -62.74 -59.97 4.15 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.563 178.459 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 40.8 tp -55.69 -53.23 59.18 Favored 'General case' 0 CA--C 1.497 -1.093 0 O-C-N 123.703 0.627 . . . . 0.0 112.104 -172.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -65.07 -36.69 85.12 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.081 -175.386 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -63.29 -46.43 86.81 Favored 'General case' 0 C--O 1.242 0.706 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.404 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 597' ' ' ILE . . . . . 0.489 HG13 ' O ' ' A' ' 593' ' ' TYR . 80.4 mt -57.66 -57.99 8.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.477 176.071 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 94.7 t -62.0 -41.72 92.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.637 -175.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 599' ' ' ALA . . . . . 0.429 ' O ' ' HG2' ' A' ' 603' ' ' GLU . . . -59.74 -46.11 90.15 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 120.886 0.374 . . . . 0.0 110.004 178.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -64.45 -46.34 83.57 Favored 'General case' 0 C--O 1.211 -0.963 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.563 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -62.54 -34.68 77.4 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 123.82 0.848 . . . . 0.0 111.727 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 602' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -65.71 -54.9 21.07 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.399 -179.166 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 603' ' ' GLU . . . . . 0.429 ' HG2' ' O ' ' A' ' 599' ' ' ALA . 12.0 pt-20 -75.61 -17.06 60.14 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.84 -177.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -69.4 -40.53 77.28 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 28.4 ttt . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 124.749 1.22 . . . . 0.0 109.779 -176.582 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 89.0 mt . . . . . 0 N--CA 1.437 -1.091 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 467' ' ' SER . . . . . 0.446 ' HB3' ' OE1' ' A' ' 470' ' ' GLU . 33.0 t -85.46 174.66 9.34 Favored 'General case' 0 C--N 1.272 -2.795 0 CA-C-N 114.461 -1.245 . . . . 0.0 111.889 -171.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 10.0 ptm85 -65.5 -22.86 66.77 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.611 -1.631 . . . . 0.0 110.744 176.39 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.496 HE21 HG23 ' A' ' 563' ' ' ILE . 51.0 mt-30 -67.27 -34.35 77.24 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 177.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.446 ' OE1' ' HB3' ' A' ' 467' ' ' SER . 2.3 mp0 -73.86 -23.2 59.58 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.509 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.02 -33.38 70.3 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 106.168 -1.79 . . . . 0.0 106.168 174.293 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 472' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 469' ' ' GLN . . . -67.25 -42.29 84.16 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.492 174.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.7 -60.62 2.96 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 122.37 1.081 . . . . 0.0 109.257 172.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 55.2 mtt180 -52.83 -46.34 67.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 113.66 -1.609 . . . . 0.0 112.466 -178.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -70.89 -36.82 72.92 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -62.95 -29.84 71.11 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 121.577 0.703 . . . . 0.0 110.57 -178.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 91.5 mt -73.23 -7.33 51.0 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.968 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 542' ' ' LEU . 37.8 ttmt -77.17 -13.67 59.91 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 176.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 54.8 t60 -60.66 137.74 58.15 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 63.2 mt -51.52 123.35 9.67 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-O 122.126 0.965 . . . . 0.0 112.573 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 52.4 mtt -71.74 1.26 7.12 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.286 -1.779 . . . . 0.0 113.502 -170.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -68.08 -44.65 75.82 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 171.665 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -74.7 58.78 0.82 Allowed 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 126.485 1.914 . . . . 0.0 111.879 -174.153 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 484' ' ' LYS . . . . . 0.634 ' HE3' HD23 ' A' ' 511' ' ' LEU . 12.5 mmmm -62.14 -18.01 59.59 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.965 -1.016 . . . . 0.0 113.346 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -57.46 -39.85 77.23 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 171.805 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 19.8 m -60.17 -35.01 74.39 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.843 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 487' ' ' PHE . . . . . 0.465 ' CE1' ' HA ' ' A' ' 508' ' ' PHE . 4.9 t80 -58.62 -51.98 67.61 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-O 121.122 0.487 . . . . 0.0 110.078 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 53.9 tp -70.57 -31.48 68.53 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.809 -176.518 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -69.5 -42.11 75.2 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.007 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.66 -31.43 57.31 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -178.208 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 491' ' ' TYR . . . . . 0.41 ' O ' HG12 ' A' ' 494' ' ' VAL . 6.3 t80 -60.39 -51.1 70.91 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.45 176.43 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -85.29 -12.11 53.14 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 45.8 m -87.41 -15.16 38.57 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.634 0.731 . . . . 0.0 109.527 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 494' ' ' VAL . . . . . 0.41 HG12 ' O ' ' A' ' 491' ' ' TYR . 1.4 p -99.45 176.52 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.415 -2.216 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.01 -175.678 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -85.01 100.71 11.85 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.469 0.652 . . . . 0.0 111.811 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -65.5 -30.46 71.23 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.486 178.708 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.8 -72.04 0.21 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.67 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -92.12 -33.43 14.76 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -78.64 -7.59 57.79 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.956 -171.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.3 t -60.73 108.33 0.83 Allowed 'General case' 0 CA--C 1.563 1.445 0 CA-C-O 123.299 1.523 . . . . 0.0 111.235 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.425 ' ND2' ' HG2' ' A' ' 470' ' ' GLU . 54.2 t-20 -93.94 157.65 16.01 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 113.56 -1.655 . . . . 0.0 107.679 -178.005 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -62.84 -34.04 76.51 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 122.032 0.92 . . . . 0.0 108.821 174.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -60.18 -51.02 71.35 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.683 -1.144 . . . . 0.0 108.76 174.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -60.7 -37.64 82.35 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.859 178.268 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -63.65 -51.69 64.07 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 506' ' ' TYR . . . . . . . . . . . . 0.256 25.8 m-85 -62.84 -42.3 99.68 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 177.982 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 507' ' ' VAL . . . . . 0.492 ' O ' HD13 ' A' ' 511' ' ' LEU . 92.5 t -63.51 -56.7 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.945 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 508' ' ' PHE . . . . . 0.465 ' HA ' ' CE1' ' A' ' 487' ' ' PHE . 13.6 t80 -49.27 -48.65 45.81 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 177.289 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -61.73 -55.9 25.35 Favored 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 123.185 0.594 . . . . 0.0 111.821 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 42.9 t -61.62 -45.71 98.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.688 0.756 . . . . 0.0 110.717 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.634 HD23 ' HE3' ' A' ' 484' ' ' LYS . 10.3 mp -67.67 -31.57 71.63 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.406 -175.612 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 13.9 t60 -72.31 -32.86 66.92 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.013 176.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.0 -40.81 98.89 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.371 0.605 . . . . 0.0 110.231 -179.28 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -76.3 -36.64 58.26 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.949 176.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 515' ' ' TYR . . . . . 0.6 ' HA ' ' HB2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -53.25 -34.04 55.56 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.269 1.027 . . . . 0.0 110.223 177.595 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.59 -18.85 62.2 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.281 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -134.13 -57.76 0.85 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 117.686 -1.606 . . . . 0.0 113.772 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -152.03 107.02 3.25 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 106.028 -1.841 . . . . 0.0 106.028 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 519' ' ' ASP . . . . . 0.6 ' HB2' ' HA ' ' A' ' 515' ' ' TYR . 28.8 t0 -107.56 96.16 6.2 Favored 'General case' 0 C--N 1.284 -2.267 0 N-CA-C 117.718 2.488 . . . . 0.0 117.718 -163.161 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -141.96 126.3 17.63 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 113.984 -1.462 . . . . 0.0 107.722 162.058 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -100.63 132.9 45.78 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -120.19 172.3 7.88 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 523' ' ' ILE . . . . . 0.523 HG13 HD12 ' A' ' 540' ' ' ILE . 0.9 OUTLIER -52.05 -46.29 42.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 C-N-CA 126.803 2.041 . . . . 0.0 109.877 171.299 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.408 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 2.9 m -51.75 -37.22 50.23 Favored 'General case' 0 N--CA 1.428 -1.533 0 C-N-CA 125.508 1.523 . . . . 0.0 111.627 -176.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -65.23 -50.8 64.46 Favored 'General case' 0 C--O 1.248 0.992 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.799 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.536 ' HB3' HD11 ' A' ' 540' ' ' ILE . . . -65.98 -28.95 69.28 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.384 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.527 ' HA ' HG13 ' A' ' 530' ' ' VAL . 42.7 t -67.97 -35.36 71.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 C-N-CA 125.321 1.448 . . . . 0.0 110.997 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 528' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 524' ' ' SER . 98.8 mt-30 -65.9 -30.5 71.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 174.871 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.549 ' HB3' ' HG2' ' A' ' 536' ' ' ARG . 31.5 m-85 -76.5 9.42 2.71 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 175.554 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.617 ' HA ' ' CZ ' ' A' ' 536' ' ' ARG . 34.4 m -72.7 12.49 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.637 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 -176.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -108.46 -43.66 4.27 Favored 'General case' 0 C--N 1.276 -2.597 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 170.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 6.5 m -75.51 -144.07 0.02 OUTLIER 'General case' 0 C--N 1.289 -2.05 0 C-N-CA 127.73 2.412 . . . . 0.0 112.512 -178.606 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 533' ' ' ASN . . . . . 0.461 ' O ' ' N ' ' A' ' 535' ' ' LEU . 16.8 m120 -26.64 30.94 0.0 OUTLIER 'General case' 0 CA--C 1.469 -2.14 1 C-N-CA 138.99 6.916 . . . . 0.0 118.402 179.017 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 534' ' ' GLU . . . . . 0.534 ' HA ' ' NE ' ' A' ' 536' ' ' ARG . 9.0 pt-20 -30.07 -5.91 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.752 0 C-N-CA 130.769 3.628 . . . . 0.0 116.904 -175.127 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.57 HD13 ' H ' ' A' ' 535' ' ' LEU . 0.0 OUTLIER -68.55 -12.18 60.94 Favored 'General case' 0 CA--C 1.57 1.745 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 163.86 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.627 ' HD2' ' N ' ' A' ' 537' ' ' GLU . 3.8 ppt_? -66.8 -28.76 68.64 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 126.65 1.98 . . . . 0.0 109.9 169.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 537' ' ' GLU . . . . . 0.627 ' N ' ' HD2' ' A' ' 536' ' ' ARG . 43.3 tt0 -77.05 -41.0 44.2 Favored 'General case' 0 CA--C 1.479 -1.77 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' A' ' 541' ' ' SER . 18.5 m -56.3 -47.73 78.09 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.254 173.194 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 55.7 tp -57.59 -45.65 85.02 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 122.825 0.45 . . . . 0.0 111.526 176.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 540' ' ' ILE . . . . . 0.536 HD11 ' HB3' ' A' ' 526' ' ' ALA . 24.8 mm -61.25 -40.45 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 176.224 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 541' ' ' SER . . . . . 0.431 ' HB3' ' O ' ' A' ' 538' ' ' THR . 35.9 t -57.24 -41.59 79.85 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 123.543 0.737 . . . . 0.0 110.033 174.461 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.405 ' O ' ' HE2' ' A' ' 478' ' ' LYS . 3.8 mm? -63.09 -37.72 88.32 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.164 174.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -68.7 -32.49 72.34 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-O 121.542 0.687 . . . . 0.0 110.441 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.5 tp60 -67.54 -34.95 78.13 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.122 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -70.61 136.41 49.15 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.68 172.117 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -102.75 141.72 35.08 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -169.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 87.1 mt -82.55 4.4 24.7 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.068 -1.424 . . . . 0.0 109.193 171.666 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -73.08 -58.07 3.58 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.955 -1.02 . . . . 0.0 108.71 174.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -74.65 -6.06 46.58 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.226 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -109.22 139.5 21.09 Favored Pre-proline 0 C--N 1.306 -1.287 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.611 177.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -71.3 152.36 61.14 Favored 'Trans proline' 0 C--O 1.242 0.718 0 N-CA-C 107.166 -1.898 . . . . 0.0 107.166 168.115 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -76.32 -2.49 31.9 Favored 'General case' 0 CA--C 1.503 -0.833 0 C-N-CA 118.669 -1.212 . . . . 0.0 112.794 -176.215 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 553' ' ' GLU . . . . . 0.69 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 44.2 mp0 -74.96 -13.48 60.52 Favored 'General case' 0 C--N 1.278 -2.505 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.032 173.924 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -69.31 -21.56 63.85 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.458 172.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -78.98 -92.74 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.552 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 28.5 pt -58.89 -45.5 91.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -174.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 557' ' ' ASP . . . . . 0.69 ' HB3' ' O ' ' A' ' 553' ' ' GLU . 3.4 t70 -60.27 -60.75 3.32 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 117.783 0.265 . . . . 0.0 110.509 -178.094 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.02 -41.77 98.45 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.976 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -54.69 -52.77 61.36 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 124.251 1.02 . . . . 0.0 111.026 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.07 -46.67 90.62 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.518 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -55.33 -46.42 76.36 Favored 'General case' 0 C--O 1.204 -1.296 0 C-N-CA 123.494 0.717 . . . . 0.0 112.503 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 562' ' ' VAL . . . . . 0.543 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 53.1 t -66.62 -40.42 86.2 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.123 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.496 HG23 HE21 ' A' ' 469' ' ' GLN . 54.1 mt -83.37 -32.78 9.44 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.298 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.75 -174.979 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -89.88 -8.24 52.35 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.941 -176.563 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 12.4 pt-20 -76.72 -20.06 56.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 177.442 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? . . . . . 0 CA--C 1.562 1.416 0 CA-C-N 113.988 -1.46 . . . . 0.0 109.062 179.794 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.5 pp . . . . . 0 C--O 1.241 0.615 0 N-CA-C 116.137 1.903 . . . . 0.0 116.137 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 467' ' ' SER . . . . . 0.441 ' O ' ' HG2' ' A' ' 470' ' ' GLU . 28.8 m -89.14 137.13 32.6 Favored 'General case' 0 N--CA 1.42 -1.959 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.711 -178.498 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 468' ' ' ARG . . . . . 0.478 HH21 ' CD ' ' A' ' 565' ' ' GLU . 20.1 ptt180 -60.09 -23.06 63.5 Favored 'General case' 0 C--O 1.26 1.643 0 CA-C-O 122.103 0.954 . . . . 0.0 111.001 176.51 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.456 ' OE1' ' HD2' ' A' ' 566' ' ' LYS . 0.0 OUTLIER -57.03 -38.17 72.78 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.837 177.361 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.635 ' O ' ' HG2' ' A' ' 474' ' ' ARG . 9.1 pt-20 -71.22 -21.9 62.07 Favored 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 119.281 -0.968 . . . . 0.0 111.699 -174.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -73.1 -39.99 65.35 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -60.75 -40.45 92.5 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.091 175.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 473' ' ' GLU . . . . . 0.429 ' HG2' ' HA ' ' A' ' 470' ' ' GLU . 49.0 mm-40 -61.16 -35.71 77.86 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.79 176.529 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.635 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 21.0 mmt85 -58.63 -42.26 87.87 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -71.46 -47.42 55.82 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.581 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -58.43 -34.15 70.48 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 122.231 1.015 . . . . 0.0 110.794 -178.017 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.501 HD21 HG11 ' A' ' 507' ' ' VAL . 23.7 tp -61.49 -10.62 8.17 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 125.987 1.715 . . . . 0.0 111.776 178.245 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.584 ' HD2' ' O ' ' A' ' 542' ' ' LEU . 9.0 mmpt? -82.57 -12.17 57.91 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.334 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 44.6 m170 -70.96 138.71 50.24 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.861 177.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 95.1 mt -65.62 137.99 57.71 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 121.478 0.656 . . . . 0.0 111.377 -175.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 481' ' ' MET . . . . . 0.497 ' C ' ' HG3' ' A' ' 520' ' ' GLN . 0.9 OUTLIER -67.13 3.28 1.2 Allowed 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.449 -1.251 . . . . 0.0 114.305 -174.235 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 482' ' ' ARG . . . . . 0.454 ' N ' ' HG3' ' A' ' 520' ' ' GLN . 18.8 tpt180 -66.8 -35.17 79.45 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 172.184 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -77.5 59.71 1.96 Allowed 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.363 172.347 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -44.13 -30.3 0.74 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.138 1.375 . . . . 0.0 111.999 177.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -56.73 -58.57 7.51 Favored 'General case' 0 C--O 1.197 -1.663 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.699 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 98.8 m -53.19 -39.35 63.58 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.323 0.649 . . . . 0.0 112.002 -178.341 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 487' ' ' PHE . . . . . 0.423 ' CE1' ' HB3' ' A' ' 511' ' ' LEU . 41.6 t80 -54.87 -59.48 4.68 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 121.106 0.479 . . . . 0.0 109.985 177.646 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 99.6 mt -81.64 -19.22 42.22 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 120.131 -0.628 . . . . 0.0 112.477 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -70.97 -39.09 72.73 Favored 'General case' 0 CA--C 1.5 -0.97 0 C-N-CA 122.702 0.401 . . . . 0.0 110.23 177.672 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -34.15 53.41 Favored 'General case' 0 N--CA 1.425 -1.679 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -178.259 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -66.36 -24.02 66.43 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 120.188 -0.605 . . . . 0.0 112.457 172.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -88.75 -27.26 21.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 121.029 0.443 . . . . 0.0 111.728 176.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 50.1 m -75.94 -31.02 58.89 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 121.823 -0.548 . . . . 0.0 110.911 -178.014 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 34.3 t -106.89 155.54 7.55 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 177.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -93.24 134.75 35.12 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 119.038 -1.065 . . . . 0.0 108.457 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.46 ' H ' ' HD2' ' A' ' 496' ' ' LYS 0.26 0.1 OUTLIER -89.59 -42.69 11.26 Favored 'General case' 0 C--N 1.285 -2.231 0 N-CA-C 117.55 2.426 . . . . 0.0 117.55 -164.919 . . . . . . . . 4 4 . 1 . 002 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -60.21 -42.64 95.58 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 -165.751 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -93.81 -22.89 18.39 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 119.135 -1.026 . . . . 0.0 112.099 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -81.79 -26.85 34.05 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.136 0.493 . . . . 0.0 111.37 -174.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 89.5 m -71.81 101.39 2.6 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.553 0.692 . . . . 0.0 111.476 -179.348 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -78.4 167.86 20.68 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 171.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -58.59 -25.94 63.12 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.357 0.526 . . . . 0.0 110.212 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 503' ' ' HIS . . . . . 0.655 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 14.8 m80 -57.69 -60.16 4.11 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.76 174.283 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -61.0 -32.22 71.81 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.055 -0.975 . . . . 0.0 112.004 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -64.37 -46.73 82.11 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 123.332 0.653 . . . . 0.0 110.676 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.655 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.266 13.7 p90 -66.06 -36.83 84.26 Favored 'General case' 0 N--CA 1.437 -1.083 0 C-N-CA 118.255 -1.378 . . . . 0.0 111.862 179.856 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 507' ' ' VAL . . . . . 0.501 HG11 HD21 ' A' ' 477' ' ' LEU . 12.9 t -66.5 -53.38 36.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.554 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -48.24 -45.94 34.93 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 124.283 0.989 . . . . 0.0 110.51 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -57.42 -53.56 56.78 Favored 'General case' 0 C--O 1.209 -1.069 0 O-C-N 123.848 0.717 . . . . 0.0 111.649 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 506' ' ' TYR . 21.8 t -55.85 -54.7 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 CA-C-O 121.543 0.687 . . . . 0.0 109.729 -178.431 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.423 ' HB3' ' CE1' ' A' ' 487' ' ' PHE . 7.4 mp -60.88 -53.96 50.9 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.759 -175.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -65.86 -38.03 87.76 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 123.829 0.852 . . . . 0.0 112.304 -177.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -67.52 -40.63 85.08 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 117.469 0.122 . . . . 0.0 111.18 -176.564 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -71.58 -49.05 44.14 Favored 'General case' 0 C--O 1.204 -1.342 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -50.88 -39.75 54.77 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.291 1.036 . . . . 0.0 110.451 178.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -62.11 -29.71 70.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.982 -0.553 . . . . 0.0 112.186 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -107.31 -40.43 5.39 Favored 'General case' 0 C--N 1.307 -1.257 0 C-N-CA 119.884 -0.726 . . . . 0.0 111.388 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -128.21 -176.92 3.95 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.809 -167.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -76.41 -154.84 0.05 Allowed 'General case' 0 C--N 1.293 -1.885 0 C-N-CA 128.002 2.521 . . . . 0.0 112.001 177.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 520' ' ' GLN . . . . . 0.497 ' HG3' ' C ' ' A' ' 481' ' ' MET . 35.1 tt0 -58.51 146.97 33.6 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 125.068 1.347 . . . . 0.0 112.111 -166.392 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -90.87 146.33 24.01 Favored 'General case' 0 N--CA 1.383 -3.785 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -112.98 157.62 21.27 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.062 -176.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.6 pp -72.11 -10.81 14.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.676 0.751 . . . . 0.0 110.601 178.11 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 19.4 m -58.38 -38.35 77.12 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.203 170.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -65.12 -36.11 83.25 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.032 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -61.57 -48.84 79.13 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.2 177.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.423 ' O ' HG22 ' A' ' 530' ' ' VAL . 10.6 p -68.36 -28.47 40.7 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-O 121.324 0.583 . . . . 0.0 110.961 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -74.51 -12.14 60.4 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.559 -0.713 . . . . 0.0 110.633 173.714 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -29.28 47.17 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.502 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 527' ' ' VAL 0.337 30.1 m -73.93 54.02 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -173.592 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -107.07 -29.06 9.62 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 173.385 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 13.0 m -90.33 155.48 18.94 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 172.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -69.12 -73.76 0.14 Allowed 'General case' 0 C--O 1.203 -1.359 0 N-CA-C 116.483 2.031 . . . . 0.0 116.483 -172.825 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -80.19 -64.34 1.21 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -164.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 84.5 mt -57.15 -42.49 81.11 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-O 121.702 0.763 . . . . 0.0 112.46 -168.208 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -79.55 -29.31 41.32 Favored 'General case' 0 N--CA 1.398 -3.044 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.962 -175.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -70.03 -39.97 75.46 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 174.018 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.401 ' O ' HD13 ' A' ' 542' ' ' LEU . 40.3 m -54.28 -46.12 72.64 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.892 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 539' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 539' ' ' LEU . 0.4 OUTLIER -60.88 -43.67 98.15 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.631 178.836 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 540' ' ' ILE . . . . . 0.428 HD13 ' HA ' ' A' ' 540' ' ' ILE . 13.8 mm -62.86 -40.71 89.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 CA-C-O 120.836 0.35 . . . . 0.0 110.923 176.228 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.1 m -54.1 -41.42 68.28 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.381 174.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.584 ' O ' ' HD2' ' A' ' 478' ' ' LYS . 10.3 mp -66.79 -49.79 64.72 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.611 172.129 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -54.39 -46.72 73.16 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 125.423 1.489 . . . . 0.0 111.608 -173.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -72.78 12.74 0.46 Allowed 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -176.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -67.03 133.39 49.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 172.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -93.31 92.2 7.58 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.883 -0.727 . . . . 0.0 109.48 -177.627 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 3.5 pp -81.86 -22.78 36.75 Favored 'General case' 0 C--O 1.205 -1.24 0 CA-C-N 115.428 -0.806 . . . . 0.0 112.077 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -75.61 -12.4 60.2 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.932 0.872 . . . . 0.0 110.292 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -71.7 -36.0 70.42 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.454 -1.248 . . . . 0.0 112.26 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -125.16 143.59 44.74 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-O 119.308 -0.377 . . . . 0.0 110.132 -174.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -36.79 129.17 0.49 Allowed 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 124.084 3.189 . . . . 0.0 113.246 174.132 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -79.93 -15.35 57.49 Favored 'General case' 0 CA--C 1.491 -1.299 0 CA-C-O 122.331 1.062 . . . . 0.0 110.502 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -78.8 -12.79 60.04 Favored 'General case' 0 N--CA 1.401 -2.924 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.137 175.765 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -74.09 -36.45 64.28 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 175.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -59.04 -60.13 4.36 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.628 -177.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 31.2 pt -57.74 -34.4 47.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 O-C-N 123.34 0.4 . . . . 0.0 111.935 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -62.77 -56.28 18.98 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.868 0.842 . . . . 0.0 109.234 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 558' ' ' ASP . . . . . 0.627 ' O ' HG23 ' A' ' 562' ' ' VAL . 27.0 t70 -59.45 -50.37 74.19 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.504 -1.225 . . . . 0.0 109.754 178.178 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 559' ' ' TYR . . . . . 0.527 ' O ' HD13 ' A' ' 563' ' ' ILE . 78.0 t80 -50.82 -53.51 31.49 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 125.564 1.546 . . . . 0.0 111.973 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 560' ' ' VAL . . . . . 0.432 ' O ' ' HB3' ' A' ' 564' ' ' ASN . 14.4 p -59.84 -40.14 81.9 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.51 -178.479 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -62.62 -47.65 82.84 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 123.128 0.571 . . . . 0.0 111.287 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 562' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 558' ' ' ASP . 38.2 t -69.81 -30.03 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 C-N-CA 123.87 0.868 . . . . 0.0 112.236 -178.497 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.527 HD13 ' O ' ' A' ' 559' ' ' TYR . 1.3 mp -86.84 -48.98 15.27 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.489 0 CA-C-O 122.222 1.01 . . . . 0.0 109.346 -172.504 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 564' ' ' ASN . . . . . 0.432 ' HB3' ' O ' ' A' ' 560' ' ' VAL . 26.9 t-20 -78.26 4.35 13.0 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.18 -1.373 . . . . 0.0 109.582 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.478 ' CD ' HH21 ' A' ' 468' ' ' ARG . 2.5 tm-20 -65.3 -28.07 69.06 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 172.361 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 566' ' ' LYS . . . . . 0.456 ' HD2' ' OE1' ' A' ' 469' ' ' GLN . 68.4 mttm . . . . . 0 N--CA 1.477 0.9 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.068 175.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 5.8 mp . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 467' ' ' SER . . . . . 0.484 ' OG ' ' HB2' ' A' ' 469' ' ' GLN . 21.9 t -111.27 124.16 51.67 Favored 'General case' 0 N--CA 1.405 -2.71 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -169.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -67.3 -28.84 68.33 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 168.912 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.484 ' HB2' ' OG ' ' A' ' 467' ' ' SER . 1.7 mp0 -68.66 -42.97 77.15 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 124.445 1.098 . . . . 0.0 110.18 -178.41 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.562 ' OE2' ' HB2' ' A' ' 501' ' ' ASN . 0.7 OUTLIER -68.61 -34.8 76.4 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.266 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -63.49 -36.09 82.6 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.178 172.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -62.65 -33.67 75.51 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.299 0.571 . . . . 0.0 109.91 176.834 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 473' ' ' GLU . . . . . 0.423 ' HA ' ' HB2' ' A' ' 476' ' ' PHE . 52.7 mt-10 -73.72 -28.69 61.84 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.808 175.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -69.07 -32.92 72.72 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 173.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -69.4 -40.93 77.06 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.504 174.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 476' ' ' PHE . . . . . 0.423 ' HB2' ' HA ' ' A' ' 473' ' ' GLU . 0.1 OUTLIER -59.37 -27.78 66.27 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.697 176.003 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 477' ' ' LEU . 19.4 mt -69.97 -8.97 53.34 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 178.22 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.489 ' HG3' ' N ' ' A' ' 479' ' ' HIS . 59.3 pttt -43.08 -51.13 5.96 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 124.386 1.054 . . . . 0.0 110.289 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.489 ' N ' ' HG3' ' A' ' 478' ' ' LYS . 3.9 p80 46.29 161.31 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 128.488 2.715 . . . . 0.0 116.218 178.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.425 ' HB2' ' HG2' ' A' ' 482' ' ' ARG . 65.2 mt -143.21 -154.66 0.54 Allowed 'General case' 0 C--N 1.281 -2.407 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 170.637 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.34 -28.27 19.94 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 482' ' ' ARG . . . . . 0.63 ' HG3' ' N ' ' A' ' 483' ' ' ASP . 23.2 ptt180 -64.41 -52.96 55.53 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.991 1.317 . . . . 0.0 113.078 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 483' ' ' ASP . . . . . 0.63 ' N ' ' HG3' ' A' ' 482' ' ' ARG 0.252 1.1 p30 -76.6 31.29 0.13 Allowed 'General case' 0 N--CA 1.419 -1.993 0 N-CA-C 117.172 2.286 . . . . 0.0 117.172 -164.979 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 484' ' ' LYS . . . . . 0.494 ' HD2' ' N ' ' A' ' 485' ' ' ASP . 0.1 OUTLIER -67.41 -28.43 67.91 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 170.695 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 485' ' ' ASP . . . . . 0.494 ' N ' ' HD2' ' A' ' 484' ' ' LYS . 4.7 p-10 -63.05 -44.77 94.92 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.304 174.985 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.45 ' HB ' ' HB2' ' A' ' 483' ' ' ASP . 43.5 m -65.17 -39.98 93.68 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 124.015 0.926 . . . . 0.0 110.17 -179.334 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -54.34 -54.46 40.07 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.208 174.423 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 36.2 tp -66.14 -34.22 77.55 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.671 -177.062 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -67.68 -31.13 70.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.714 -178.219 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.61 -41.55 19.35 Favored 'General case' 0 N--CA 1.401 -2.907 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.99 -52.11 66.87 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.264 1.826 . . . . 0.0 110.831 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.39 -20.08 59.15 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.313 -173.216 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 59.4 m -81.13 -47.23 13.77 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 119.917 -0.713 . . . . 0.0 111.982 -174.709 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 40.1 t -137.31 123.43 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 C-N-CA 120.464 -0.494 . . . . 0.0 109.813 -175.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -86.63 45.64 1.27 Allowed 'General case' 0 CA--C 1.55 0.965 0 CA-C-O 122.606 1.193 . . . . 0.0 110.146 -177.58 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.418 ' HG2' ' H ' ' A' ' 496' ' ' LYS . 50.9 pttt -89.16 14.83 9.92 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.659 -177.3 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.27 -11.05 48.1 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 -170.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -84.66 -22.66 29.78 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.875 0.845 . . . . 0.0 109.14 175.371 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -79.99 -43.58 21.75 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.4 m -54.94 154.05 5.69 Favored 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.876 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.562 ' HB2' ' OE2' ' A' ' 470' ' ' GLU . 12.7 t-20 -66.42 150.02 49.54 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 124.806 1.242 . . . . 0.0 111.496 -174.533 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -65.41 -21.73 66.7 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.048 0.539 . . . . 0.0 110.313 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 503' ' ' HIS . . . . . 0.645 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 49.3 m80 -61.43 -44.25 97.45 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -65.78 -31.73 72.87 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.331 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 508' ' ' PHE . 46.8 tttm -61.81 -52.93 62.15 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 122.635 0.374 . . . . 0.0 110.594 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.645 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.282 47.0 p90 -66.2 -25.19 66.81 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 117.516 -1.674 . . . . 0.0 111.863 -179.796 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 97.4 t -72.53 -40.38 63.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.367 174.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 508' ' ' PHE . . . . . 0.41 ' HB2' ' O ' ' A' ' 505' ' ' LYS . 8.2 m-85 -48.67 -50.47 32.97 Favored 'General case' 0 C--O 1.199 -1.6 0 C-N-CA 123.399 0.679 . . . . 0.0 109.526 171.139 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 509' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 513' ' ' ASP . 38.6 mt-10 -57.28 -49.7 75.26 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.371 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 506' ' ' TYR . 9.9 t -60.43 -53.82 43.51 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.832 0 O-C-N 123.75 0.656 . . . . 0.0 109.262 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.433 ' HA ' ' HB2' ' A' ' 514' ' ' PHE . 95.8 mt -69.24 -32.29 71.41 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 113.431 0.9 . . . . 0.0 113.431 -174.515 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -67.07 -49.47 64.99 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.237 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 513' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 509' ' ' GLU . 0.4 OUTLIER -58.55 -38.39 77.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.368 173.843 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 514' ' ' PHE . . . . . 0.75 ' O ' ' HA ' ' A' ' 518' ' ' ASN . 13.8 m-85 -75.75 -3.87 37.29 Favored 'General case' 0 C--O 1.186 -2.279 0 C-N-CA 124.886 1.275 . . . . 0.0 114.31 174.535 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 515' ' ' TYR . . . . . 0.499 ' O ' ' HB3' ' A' ' 518' ' ' ASN . 2.6 m-85 -82.83 -35.62 26.22 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 121.154 -0.966 . . . . 0.0 110.356 165.778 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -68.61 -47.17 67.35 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 170.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -99.02 61.45 1.25 Allowed 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 104.752 -2.314 . . . . 0.0 104.752 174.142 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 518' ' ' ASN . . . . . 0.75 ' HA ' ' O ' ' A' ' 514' ' ' PHE . 3.1 p-10 -59.61 -151.27 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 128.844 2.858 . . . . 0.0 116.125 -163.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . 0.358 3.3 p30 -31.54 -152.75 0.0 OUTLIER 'General case' 0 N--CA 1.528 3.441 0 N-CA-C 119.605 3.187 . . . . 0.0 119.605 -138.334 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -53.18 125.07 16.28 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 124.01 1.862 . . . . 0.0 114.937 -145.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.83 176.58 6.21 Favored 'General case' 0 N--CA 1.416 -2.134 0 CA-C-N 109.648 -3.433 . . . . 0.0 110.483 -168.466 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -108.03 136.51 47.6 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -174.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 36.8 pt -79.19 -14.48 13.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 175.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.469 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 37.0 t -57.13 -30.97 64.87 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.642 172.071 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -63.03 -42.58 99.82 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -62.17 -45.27 94.17 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.295 177.227 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 530' ' ' VAL . 61.8 t -62.1 -26.07 39.12 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.702 0 CA-C-O 121.493 0.663 . . . . 0.0 111.186 175.463 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 528' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 524' ' ' SER . 21.7 mm-40 -71.16 -23.53 62.08 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 120.759 -1.213 . . . . 0.0 109.709 174.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.455 ' O ' ' HD3' ' A' ' 536' ' ' ARG . 16.2 m-85 -70.61 -31.71 68.78 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.901 174.231 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 527' ' ' VAL 0.326 14.6 p -74.97 54.73 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.321 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -172.406 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -107.02 -42.26 4.95 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 173.502 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 532' ' ' SER . . . . . 0.416 ' HB2' ' HD2' ' A' ' 536' ' ' ARG . 11.7 m -79.0 141.44 37.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 106.004 -1.85 . . . . 0.0 106.004 171.229 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -68.11 -84.0 0.03 OUTLIER 'General case' 0 C--O 1.198 -1.641 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 -173.452 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -52.63 -64.98 0.64 Allowed 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 116.113 1.894 . . . . 0.0 116.113 -166.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 44.8 tp -57.14 -57.05 14.3 Favored 'General case' 0 C--O 1.267 2.004 0 CA-C-O 122.579 1.18 . . . . 0.0 111.299 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.455 ' HD3' ' O ' ' A' ' 529' ' ' TYR . 62.8 mtt85 -76.19 -38.25 56.79 Favored 'General case' 0 N--CA 1.41 -2.462 0 CA-C-N 114.11 -1.405 . . . . 0.0 113.686 -171.44 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -61.27 -43.88 98.15 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 118.243 0.474 . . . . 0.0 110.042 175.3 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.469 ' O ' HD13 ' A' ' 542' ' ' LEU . 93.4 m -55.44 -43.39 75.37 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 123.779 0.674 . . . . 0.0 111.045 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 539' ' ' LEU . . . . . 0.459 ' HB2' ' OH ' ' A' ' 506' ' ' TYR . 0.4 OUTLIER -57.9 -45.3 86.67 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.514 177.465 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 540' ' ' ILE . . . . . 0.595 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 1.7 mp -58.28 -43.96 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 CA-C-O 121.009 0.433 . . . . 0.0 110.368 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 19.8 m -54.5 -41.98 70.23 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.211 174.781 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 538' ' ' THR . 9.1 mp -62.83 -42.12 99.6 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.909 0.484 . . . . 0.0 110.472 175.573 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 543' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 478' ' ' LYS . 40.5 tt0 -61.1 -37.23 82.01 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.166 0.986 . . . . 0.0 111.78 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 544' ' ' GLN . . . . . 0.595 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 72.8 mt-30 -68.83 -29.0 67.24 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.138 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -76.96 84.4 3.49 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-O 121.767 0.794 . . . . 0.0 111.576 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -136.87 136.58 38.85 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.568 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 6.8 mp -90.35 23.54 2.9 Favored 'General case' 0 C--N 1.299 -1.596 0 C-N-CA 124.288 1.035 . . . . 0.0 111.209 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.08 -23.34 66.44 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -170.537 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -70.08 -15.49 62.99 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.891 0.377 . . . . 0.0 111.033 176.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -117.61 118.32 35.26 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -84.63 38.74 0.7 Allowed 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.948 2.432 . . . . 0.0 110.968 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -128.5 48.61 2.29 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -70.03 66.82 0.27 Allowed 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -175.586 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.07 -21.86 65.87 Favored 'General case' 0 C--O 1.214 -0.789 0 C-N-CA 125.657 1.583 . . . . 0.0 109.114 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -45.37 -38.44 5.87 Favored 'General case' 0 C--O 1.197 -1.659 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.89 174.021 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 43.9 mt -70.93 -42.24 77.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 123.283 0.633 . . . . 0.0 109.545 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -60.49 -47.3 86.75 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 121.957 0.884 . . . . 0.0 109.389 176.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -57.64 -48.54 79.18 Favored 'General case' 0 C--O 1.211 -0.954 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.296 175.673 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 559' ' ' TYR . . . . . 0.446 ' O ' HG13 ' A' ' 563' ' ' ILE . 27.9 t80 -56.89 -53.86 53.17 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 125.47 1.508 . . . . 0.0 110.42 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 40.4 t -58.4 -54.98 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.225 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.598 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 2.4 t30 -63.68 -42.78 97.98 Favored 'General case' 0 C--O 1.181 -2.502 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.994 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 2.6 p -65.75 -33.64 64.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 118.158 0.435 . . . . 0.0 112.108 -173.344 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 559' ' ' TYR . 27.9 mt -84.82 -29.24 6.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.538 0.685 . . . . 0.0 109.567 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -78.47 -36.19 45.61 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.668 -178.692 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 561' ' ' ASN . 12.3 pt-20 -75.09 -7.65 54.34 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 122.186 0.993 . . . . 0.0 110.401 -177.999 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? . . . . . 0 N--CA 1.442 -0.842 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.988 177.913 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 92.6 mt . . . . . 0 N--CA 1.428 -1.559 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 467' ' ' SER . . . . . 0.547 ' O ' ' HG2' ' A' ' 470' ' ' GLU . 47.3 t -95.05 141.09 29.1 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.681 -174.756 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -65.67 -22.42 66.64 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.252 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -62.26 -36.93 83.57 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.46 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 467' ' ' SER . 14.4 pt-20 -74.96 -23.92 58.37 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.723 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -71.35 -36.49 71.52 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -63.04 -48.41 78.83 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.59 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -56.66 -41.7 77.71 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.179 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 9.9 mmt-85 -57.41 -40.89 79.27 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.163 0.506 . . . . 0.0 109.89 175.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 475' ' ' ALA . . . . . 0.647 ' O ' ' HG3' ' A' ' 478' ' ' LYS . . . -65.54 -40.22 92.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.939 -178.449 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.57 -48.04 76.48 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.857 0.837 . . . . 0.0 110.81 173.077 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 31.8 tp -70.26 -3.17 15.84 Favored 'General case' 0 CA--C 1.571 1.761 0 C-N-CA 126.289 1.836 . . . . 0.0 114.456 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.647 ' HG3' ' O ' ' A' ' 475' ' ' ALA . 35.4 mtmm -41.66 -63.47 0.71 Allowed 'General case' 0 N--CA 1.511 2.579 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -172.214 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.535 ' CG ' ' HA ' ' A' ' 543' ' ' GLU . 0.4 OUTLIER -170.15 89.7 0.16 Allowed 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 121.918 0.866 . . . . 0.0 110.425 -179.447 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.549 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 96.1 mt -133.12 100.27 4.82 Favored 'General case' 0 C--N 1.278 -2.511 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -83.6 -72.68 0.45 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 114.44 -1.255 . . . . 0.0 112.036 -171.203 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -9.02 50.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 -179.202 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 483' ' ' ASP . . . . . 0.549 ' HB2' ' HB3' ' A' ' 480' ' ' LEU . 0.7 OUTLIER -70.79 57.67 0.2 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 125.152 1.381 . . . . 0.0 113.957 -177.524 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 484' ' ' LYS . . . . . 0.418 ' HE3' ' OH ' ' A' ' 515' ' ' TYR . 20.6 ptmt -54.95 -40.59 70.11 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 123.572 0.749 . . . . 0.0 111.321 178.148 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -63.39 -44.96 93.2 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.543 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 26.8 m -62.68 -39.06 92.76 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.208 0.203 . . . . 0.0 111.365 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 487' ' ' PHE . . . . . 0.441 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 61.6 t80 -56.02 -49.64 73.12 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 176.586 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.9 -31.71 66.67 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.941 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -68.58 -37.71 80.09 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.951 0.9 . . . . 0.0 111.571 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -84.67 -23.66 29.32 Favored 'General case' 0 N--CA 1.413 -2.298 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.21 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 491' ' ' TYR . . . . . 0.441 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.1 OUTLIER -65.12 -46.11 82.32 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 176.213 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.38 -6.91 56.58 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.273 0.559 . . . . 0.0 111.247 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 36.8 t -78.8 -18.4 54.18 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 37.7 t -129.03 98.09 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.93 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.865 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -99.25 -6.75 27.5 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 171.552 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -88.45 18.87 4.18 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 127.212 2.205 . . . . 0.0 109.62 177.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -61.16 -0.62 0.36 Allowed 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 -172.868 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -75.75 -12.91 60.27 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 175.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -77.36 -12.84 60.0 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 114.297 -1.319 . . . . 0.0 110.941 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 14.1 p -54.98 133.49 48.46 Favored 'General case' 0 CA--C 1.485 -1.546 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -170.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 43.4 t-20 -73.73 137.9 44.29 Favored 'General case' 0 N--CA 1.413 -2.282 0 N-CA-C 104.551 -2.388 . . . . 0.0 104.551 170.663 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 502' ' ' GLN . . . . . 0.436 ' O ' ' HD1' ' A' ' 506' ' ' TYR . 46.4 tt0 -62.23 -18.58 61.54 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 118.858 0.754 . . . . 0.0 110.985 -172.825 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -60.36 -41.98 94.81 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.054 175.566 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -63.56 -36.71 84.7 Favored 'General case' 0 C--O 1.209 -1.029 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.229 174.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 1.2 tmtp? -64.11 -36.07 82.83 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.074 -175.855 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.556 ' O ' HG23 ' A' ' 510' ' ' VAL . 45.6 m-85 -60.3 -54.09 49.87 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.964 172.022 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.82 -48.22 88.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.593 -177.529 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -49.82 -49.9 47.22 Favored 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 123.363 0.414 . . . . 0.0 111.636 176.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -57.92 -49.11 77.88 Favored 'General case' 0 N--CA 1.461 0.123 0 O-C-N 123.698 0.624 . . . . 0.0 110.413 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 506' ' ' TYR . 60.2 t -55.36 -58.85 3.3 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.561 0 O-C-N 123.786 0.679 . . . . 0.0 110.707 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 9.5 mp -66.27 -44.5 83.41 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.04 -175.263 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 50.9 t-80 -62.17 -53.06 60.66 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.977 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.4 -29.32 63.63 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -173.085 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 21.7 m-30 -76.68 -47.55 21.7 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.659 177.712 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 515' ' ' TYR . . . . . 0.418 ' OH ' ' HE3' ' A' ' 484' ' ' LYS . 0.6 OUTLIER -52.3 -43.55 64.54 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.591 1.156 . . . . 0.0 109.466 176.246 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -68.65 -9.61 51.09 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -121.49 -48.23 2.19 Favored 'General case' 0 C--N 1.313 -1.014 0 O-C-N 121.917 -0.49 . . . . 0.0 111.694 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -121.16 -151.01 0.47 Allowed 'General case' 0 C--N 1.29 -1.984 0 C-N-CA 123.563 0.745 . . . . 0.0 109.386 -177.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.84 -160.62 0.16 Allowed 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -75.56 179.83 5.08 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.988 -0.445 . . . . 0.0 110.173 -178.251 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 521' ' ' TYR . . . . . 0.406 ' CD2' ' HB2' ' A' ' 525' ' ' ASP . 0.1 OUTLIER -88.55 138.35 31.5 Favored 'General case' 0 N--CA 1.384 -3.729 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -176.8 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -119.29 175.8 5.63 Favored 'General case' 0 C--N 1.286 -2.183 0 CA-C-N 116.946 -0.115 . . . . 0.0 110.796 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 35.0 pt -68.73 -18.56 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.302 0.573 . . . . 0.0 110.992 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 3.5 p -59.71 -41.33 90.58 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-O 121.787 0.803 . . . . 0.0 109.741 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 525' ' ' ASP . . . . . 0.406 ' HB2' ' CD2' ' A' ' 521' ' ' TYR . 40.9 m-20 -66.82 -36.91 83.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.001 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -59.8 -49.57 77.19 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.273 178.036 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 9.5 p -68.15 -23.62 28.98 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.721 0 CA-C-O 120.903 0.382 . . . . 0.0 110.909 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 528' ' ' GLN . . . . . 0.482 ' HG3' ' O ' ' A' ' 524' ' ' SER . 98.6 mt-30 -67.28 -30.37 70.22 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 173.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.401 ' C ' ' H ' ' A' ' 531' ' ' ASN . 0.3 OUTLIER -83.17 16.59 2.35 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 173.497 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.417 HG23 ' HG3' ' A' ' 536' ' ' ARG . 5.2 p -71.63 18.89 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 CA-C-O 121.928 0.871 . . . . 0.0 111.729 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 531' ' ' ASN . . . . . 0.401 ' H ' ' C ' ' A' ' 529' ' ' TYR . 10.4 p30 -107.86 -26.16 10.88 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.579 -0.701 . . . . 0.0 111.036 -178.611 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 532' ' ' SER . . . . . 0.445 ' HB2' ' HB2' ' A' ' 535' ' ' LEU . 24.8 m -92.2 140.03 30.03 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 179.467 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 533' ' ' ASN . . . . . 0.539 ' O ' ' HG2' ' A' ' 537' ' ' GLU . 19.3 m120 -57.84 -72.23 0.09 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -170.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -66.39 -32.45 73.85 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 120.67 0.271 . . . . 0.0 111.158 -174.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 532' ' ' SER . 3.7 mm? -61.88 -50.51 71.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.391 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.417 ' HG3' HG23 ' A' ' 530' ' ' VAL . 48.4 ttt180 -62.3 -61.53 2.39 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.869 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 537' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 533' ' ' ASN . 12.7 pt-20 -61.22 -62.27 1.96 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -173.207 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.482 ' O ' HD13 ' A' ' 542' ' ' LEU . 75.7 m -65.27 -53.77 39.21 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 539' ' ' LEU . . . . . 0.435 ' HB3' ' O ' ' A' ' 535' ' ' LEU . 47.4 tp -61.38 -44.03 97.85 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.468 -174.697 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 57.2 mt -68.18 -34.83 68.68 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.492 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 28.7 t -57.35 -49.22 76.84 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 121.555 0.693 . . . . 0.0 109.477 174.999 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.482 HD13 ' O ' ' A' ' 538' ' ' THR . 6.5 mp -66.96 -24.41 66.05 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.979 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 543' ' ' GLU . . . . . 0.535 ' HA ' ' CG ' ' A' ' 479' ' ' HIS . 0.9 OUTLIER -81.42 -64.7 1.13 Allowed 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.04 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -71.67 -59.59 2.68 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.857 -171.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -73.04 90.28 1.5 Allowed 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -173.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -137.26 100.17 4.18 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 173.91 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 5.5 tt -92.35 -82.54 0.32 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 118.589 -1.244 . . . . 0.0 111.518 -173.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -104.66 -48.99 3.64 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-O 121.743 0.782 . . . . 0.0 112.137 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -68.23 36.25 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 126.842 2.057 . . . . 0.0 113.824 -172.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.44 ' HA ' ' HD3' ' A' ' 551' ' ' PRO . 12.2 pt-20 -54.97 106.11 0.62 Allowed Pre-proline 0 C--O 1.244 0.798 0 C-N-CA 123.479 0.711 . . . . 0.0 112.174 -179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 551' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 550' ' ' GLU . 43.6 Cg_endo -92.72 111.55 0.24 Allowed 'Trans proline' 0 N--CA 1.426 -2.443 0 C-N-CA 122.596 2.197 . . . . 0.0 114.389 -173.766 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -131.26 -54.14 1.03 Allowed 'General case' 0 CA--C 1.494 -1.209 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 172.266 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -75.02 -50.22 17.23 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 113.853 -1.521 . . . . 0.0 108.585 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -67.1 -24.16 65.91 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 114.27 -1.332 . . . . 0.0 109.052 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 555' ' ' GLU . . . . . 0.426 ' CD ' ' HB1' ' A' ' 475' ' ' ALA . 6.1 tp10 -68.07 -56.61 8.25 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.58 -177.237 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 72.8 mt -54.71 -40.92 53.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.21 -51.67 68.79 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.431 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -66.16 -49.45 67.34 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.192 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 559' ' ' TYR . . . . . 0.613 ' O ' HG12 ' A' ' 563' ' ' ILE . 87.5 t80 -51.49 -53.44 37.37 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 125.352 1.461 . . . . 0.0 110.233 178.644 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 75.7 t -61.41 -45.92 97.64 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.985 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -58.46 -39.72 80.68 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.741 0.416 . . . . 0.0 111.324 -179.426 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 76.3 t -70.12 -34.87 61.05 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 123.187 0.595 . . . . 0.0 112.246 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.613 HG12 ' O ' ' A' ' 559' ' ' TYR . 47.7 mm -86.37 -38.32 12.42 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -174.89 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -76.82 0.14 21.83 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 113.956 -1.475 . . . . 0.0 109.646 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -64.54 -36.17 83.35 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 104.781 -2.303 . . . . 0.0 104.781 173.391 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 566' ' ' LYS . . . . . 0.433 ' O ' ' HG2' ' A' ' 566' ' ' LYS . 54.1 tttm . . . . . 0 CA--C 1.553 1.071 0 CA-C-N 113.525 -1.67 . . . . 0.0 108.27 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 N--CA 1.44 -0.949 0 CA-C-O 121.391 0.615 . . . . 0.0 109.385 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 67.2 p -101.94 -177.84 3.53 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.191 -174.021 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.3 ptt180 -69.36 -18.19 63.76 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.235 173.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.434 ' HA ' HG12 ' A' ' 562' ' ' VAL . 98.6 mt-30 -57.54 -67.62 0.31 Allowed 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 -168.613 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.494 ' HA ' ' CB ' ' A' ' 473' ' ' GLU 0.449 11.7 pt-20 -77.1 -9.06 58.49 Favored 'General case' 0 N--CA 1.421 -1.887 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -177.957 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -67.07 -44.46 80.03 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 170.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 472' ' ' ALA . . . . . 0.467 ' HB3' HD11 ' A' ' 563' ' ' ILE . . . -67.86 -27.78 66.98 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.768 0.794 . . . . 0.0 109.184 176.256 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 473' ' ' GLU . . . . . 0.494 ' CB ' ' HA ' ' A' ' 470' ' ' GLU . 0.1 OUTLIER -70.18 -45.14 67.3 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 114.67 -1.15 . . . . 0.0 108.541 177.801 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 67.7 mtt180 -57.06 -35.31 69.19 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.19 0.519 . . . . 0.0 110.89 172.364 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 475' ' ' ALA . . . . . 0.401 ' HA ' HD12 ' A' ' 542' ' ' LEU . . . -69.5 -39.35 77.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.591 175.885 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 476' ' ' PHE . . . . . 0.554 ' O ' ' HB2' ' A' ' 479' ' ' HIS . 4.2 t80 -64.49 -38.39 90.84 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 123.69 0.796 . . . . 0.0 110.097 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 56.3 tp -63.47 -43.35 97.57 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.44 1.096 . . . . 0.0 111.162 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -74.61 -53.37 9.49 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.554 ' HB2' ' O ' ' A' ' 476' ' ' PHE . 1.7 t-80 40.05 -97.15 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.096 2.159 . . . . 0.0 113.326 177.292 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.457 ' H ' ' HB3' ' A' ' 479' ' ' HIS . 3.2 mm? -136.27 153.24 51.25 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 173.648 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 481' ' ' MET . . . . . 0.567 ' HG3' ' O ' ' A' ' 521' ' ' TYR . 58.7 ttp -54.29 -34.98 62.09 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 122.987 0.515 . . . . 0.0 112.316 -177.414 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 19.7 ptt-85 -66.83 -17.49 64.91 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -177.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 483' ' ' ASP . . . . . 0.47 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 4.6 m-20 -70.55 41.28 0.06 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 116.505 2.039 . . . . 0.0 116.505 -169.14 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 484' ' ' LYS . . . . . 0.584 ' HD2' ' CD2' ' A' ' 515' ' ' TYR . 30.6 mmtp -60.88 -42.77 98.59 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-O 121.136 0.493 . . . . 0.0 110.983 174.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -60.93 -50.41 73.52 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.093 178.534 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.47 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 59.3 m -58.32 -43.05 88.03 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 123.952 0.901 . . . . 0.0 111.266 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 487' ' ' PHE . . . . . 0.489 ' CE1' ' HB3' ' A' ' 511' ' ' LEU . 82.5 t80 -46.19 -55.35 7.23 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.748 1.219 . . . . 0.0 109.893 175.76 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 60.0 mt -79.02 -27.36 43.23 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.138 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -67.07 -41.31 86.64 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.82 -38.7 20.9 Favored 'General case' 0 N--CA 1.424 -1.764 0 C-N-CA 120.116 -0.634 . . . . 0.0 109.786 -177.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 28.9 t80 -55.14 -58.2 8.64 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -77.82 -14.38 59.59 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 120.372 -0.531 . . . . 0.0 112.221 -170.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 43.5 m -82.31 -60.99 2.02 Favored 'General case' 0 N--CA 1.425 -1.68 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -173.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 494' ' ' VAL . . . . . 0.412 HG12 ' O ' ' A' ' 495' ' ' ASP . 87.6 t -139.14 134.97 41.71 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 120.353 -0.539 . . . . 0.0 112.125 -167.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 495' ' ' ASP . . . . . 0.412 ' O ' HG12 ' A' ' 494' ' ' VAL . 12.0 m-20 -85.87 158.95 19.82 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 170.85 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.469 ' H ' ' HE3' ' A' ' 496' ' ' LYS . 0.0 OUTLIER -89.23 -90.89 0.13 Allowed 'General case' 0 CA--C 1.5 -0.962 0 C-N-CA 116.459 -2.096 . . . . 0.0 112.152 -167.08 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -106.25 -85.22 0.5 Allowed 'General case' 0 N--CA 1.431 -1.375 0 C-N-CA 114.444 -2.903 . . . . 0.0 113.02 171.059 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -127.79 -50.67 1.36 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.524 1.53 . . . . 0.0 114.991 171.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . 0.357 10.8 p90 -70.57 -93.15 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.831 1 N-CA-C 123.904 4.779 . . . . 0.0 123.904 -149.646 . . . . . . . . 3 2 . 1 . 005 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 11.4 m -93.45 89.7 6.42 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -161.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -127.25 42.02 3.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 117.769 -1.573 . . . . 0.0 114.227 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 502' ' ' GLN . . . . . 0.428 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 1.1 tm0? -90.13 -35.06 15.63 Favored 'General case' 0 CA--C 1.502 -0.902 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 168.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 503' ' ' HIS . . . . . 0.741 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 87.3 m-70 -62.86 -40.64 98.11 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.111 -178.42 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 504' ' ' PHE . . . . . 0.457 ' O ' ' HD2' ' A' ' 508' ' ' PHE . 37.2 m-85 -63.85 -40.78 97.37 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.169 175.366 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.428 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 54.2 tttp -58.77 -50.36 74.21 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 123.688 0.795 . . . . 0.0 109.7 -175.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.741 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.279 9.8 p90 -65.02 -36.62 84.98 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 118.261 -1.375 . . . . 0.0 113.265 178.997 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.85 -48.75 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 120.311 -0.555 . . . . 0.0 109.802 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 508' ' ' PHE . . . . . 0.457 ' HD2' ' O ' ' A' ' 504' ' ' PHE . 32.3 m-85 -51.79 -39.39 58.57 Favored 'General case' 0 CA--C 1.499 -0.998 0 O-C-N 123.826 0.704 . . . . 0.0 112.637 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -58.39 -61.17 2.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.747 0.654 . . . . 0.0 109.512 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 506' ' ' TYR . 32.0 t -58.29 -48.94 83.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.389 -176.778 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.489 ' HB3' ' CE1' ' A' ' 487' ' ' PHE . 2.9 tt -68.61 -40.83 80.23 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.802 -172.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -70.09 -35.11 73.94 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.89 -49.16 77.33 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.172 0.589 . . . . 0.0 110.427 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -63.45 -44.13 95.38 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.952 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 515' ' ' TYR . . . . . 0.584 ' CD2' ' HD2' ' A' ' 484' ' ' LYS . 0.7 OUTLIER -52.98 -42.32 65.43 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 124.142 0.977 . . . . 0.0 109.773 179.641 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.84 -21.34 63.38 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.139 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -116.03 -53.85 2.53 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-O 121.87 0.843 . . . . 0.0 112.198 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 518' ' ' ASN . . . . . 0.566 ' CG ' ' H ' ' A' ' 519' ' ' ASP . 22.8 t-20 -101.88 -152.36 0.44 Allowed 'General case' 0 C--N 1.281 -2.38 0 CA-C-N 114.161 -1.381 . . . . 0.0 110.248 -169.678 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 519' ' ' ASP . . . . . 0.566 ' H ' ' CG ' ' A' ' 518' ' ' ASN . 29.1 t70 -106.17 -158.15 0.64 Allowed 'General case' 0 C--N 1.272 -2.78 0 C-N-CA 128.505 2.722 . . . . 0.0 105.664 -170.619 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 520' ' ' GLN . . . . . 0.568 ' HA ' ' HE3' ' A' ' 484' ' ' LYS 0.412 3.5 pm0 -62.95 155.08 28.38 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 120.501 1.501 . . . . 0.0 112.71 178.25 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 521' ' ' TYR . . . . . 0.567 ' O ' ' HG3' ' A' ' 481' ' ' MET . 0.3 OUTLIER -84.06 131.46 34.8 Favored 'General case' 0 N--CA 1.397 -3.101 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -167.006 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -72.38 146.51 46.99 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.014 -178.451 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 523' ' ' ILE . . . . . 0.46 ' HB ' ' OE2' ' A' ' 543' ' ' GLU . 39.1 pt -84.29 -12.02 11.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.489 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 35.7 t -56.84 -38.54 72.8 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.869 175.644 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -64.62 -34.45 78.3 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.53 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -61.95 -39.6 92.66 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.114 176.802 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 56.5 t -71.17 -37.22 65.65 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.115 0 C-N-CA 124.083 0.953 . . . . 0.0 108.729 177.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 528' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.2 mm100 -67.3 -10.48 51.3 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 122.711 0.405 . . . . 0.0 111.119 178.146 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.53 ' HB2' ' O ' ' A' ' 526' ' ' ALA . 4.9 m-85 -71.13 -0.02 8.72 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.645 168.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.53 ' HA ' ' CB ' ' A' ' 536' ' ' ARG . 6.3 p -73.03 15.27 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.642 0 CA-C-O 122.288 1.042 . . . . 0.0 110.469 174.31 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 531' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 529' ' ' TYR . 5.9 t30 -97.12 -24.8 15.58 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 174.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 31.8 t -91.75 141.68 28.41 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 114.963 -1.017 . . . . 0.0 108.785 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -65.86 -51.04 62.17 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -175.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -94.95 -37.83 10.97 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.145 0.498 . . . . 0.0 111.204 -177.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.412 HD22 ' OH ' ' A' ' 506' ' ' TYR . 45.8 mt -66.32 -21.49 66.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.708 -174.135 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.53 ' CB ' ' HA ' ' A' ' 530' ' ' VAL . 36.3 ptt180 -63.47 -46.42 86.29 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.266 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.21 -49.85 75.47 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.525 -178.061 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 541' ' ' SER . 5.7 m -61.01 -54.52 43.95 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -178.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . 0.31 4.2 mm? -65.28 -35.62 81.58 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -177.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 72.1 mt -72.0 -29.64 33.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.91 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 541' ' ' SER . . . . . 0.447 ' HB2' ' O ' ' A' ' 538' ' ' THR . 73.3 m -57.41 -40.76 78.99 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.669 0.747 . . . . 0.0 109.544 168.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 475' ' ' ALA . 3.3 mm? -74.67 -13.08 60.58 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 174.054 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 543' ' ' GLU . . . . . 0.46 ' OE2' ' HB ' ' A' ' 523' ' ' ILE . 53.9 mm-40 -80.47 -40.75 25.63 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.246 0.546 . . . . 0.0 111.146 174.75 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -77.58 27.36 0.17 Allowed 'General case' 0 CA--C 1.557 1.224 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -176.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -67.84 163.7 21.31 Favored 'General case' 0 C--O 1.242 0.705 0 O-C-N 122.237 -0.289 . . . . 0.0 110.688 177.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -93.1 155.02 17.76 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.876 -0.329 . . . . 0.0 111.307 -177.1 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 88.2 mt -77.47 22.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.431 1.092 . . . . 0.0 111.952 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 548' ' ' ASN . . . . . 0.452 ' C ' ' H ' ' A' ' 550' ' ' GLU . 2.6 t-20 -79.8 21.32 0.55 Allowed 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 122.082 0.944 . . . . 0.0 110.183 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -70.08 9.65 0.53 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 125.601 1.56 . . . . 0.0 111.626 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.452 ' H ' ' C ' ' A' ' 548' ' ' ASN . 34.9 mt-10 -54.9 154.66 9.33 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 125.917 1.687 . . . . 0.0 111.873 -175.674 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -71.83 45.16 0.7 Allowed 'Trans proline' 0 N--CA 1.503 2.033 0 C-N-CA 124.666 3.577 . . . . 0.0 112.807 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -134.92 50.49 2.16 Favored 'General case' 0 C--N 1.282 -2.334 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 178.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -56.66 67.35 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 117.153 2.279 . . . . 0.0 117.153 -169.679 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 554' ' ' ASN . . . . . 0.455 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 7.6 t30 -70.65 -22.08 62.54 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.919 1.287 . . . . 0.0 107.786 171.275 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -44.93 -54.53 6.39 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.537 1.535 . . . . 0.0 110.029 177.043 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 54.6 mt -62.7 -38.86 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.396 0.678 . . . . 0.0 110.284 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 557' ' ' ASP . . . . . 0.455 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 3.2 t70 -56.57 -51.25 69.32 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 121.071 0.462 . . . . 0.0 110.611 177.416 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 558' ' ' ASP . . . . . 0.501 ' O ' HG23 ' A' ' 562' ' ' VAL . 29.6 t70 -67.13 -47.41 71.17 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.999 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 559' ' ' TYR . . . . . 0.409 ' O ' HD13 ' A' ' 563' ' ' ILE . 77.6 t80 -51.99 -53.37 42.48 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.998 1.319 . . . . 0.0 111.456 179.322 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.28 -44.24 95.26 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.679 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 9.3 t30 -63.09 -36.33 83.22 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 122.774 0.43 . . . . 0.0 112.143 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 562' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 558' ' ' ASP . 89.7 t -70.97 -50.3 43.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-O 121.591 0.71 . . . . 0.0 111.493 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.54 ' O ' ' HG3' ' A' ' 566' ' ' LYS . 1.7 mp -80.7 -55.5 8.34 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.882 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.465 -168.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -74.57 1.09 12.88 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 122.091 0.948 . . . . 0.0 111.041 -173.265 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 45.2 tt0 -67.2 -14.71 63.17 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 169.169 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 566' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 563' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.357 0.931 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.781 173.547 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 91.5 mt . . . . . 0 N--CA 1.438 -1.065 0 CA-C-O 120.718 0.294 . . . . 0.0 111.505 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 41.0 t -109.53 104.16 13.17 Favored 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 173.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -70.81 -29.13 65.22 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.551 -0.46 . . . . 0.0 112.2 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -67.65 -54.3 20.77 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.057 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.624 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 32.0 tt0 -63.48 -36.67 84.51 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -58.18 -42.43 86.06 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.483 177.353 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -65.65 -43.43 89.42 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.089 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.72 -44.5 93.7 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.457 0.703 . . . . 0.0 110.924 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.624 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 92.4 mtt180 -53.46 -54.27 39.4 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.296 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 475' ' ' ALA . . . . . 0.438 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -69.56 -43.47 72.83 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 124.146 0.903 . . . . 0.0 112.265 -178.529 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -55.12 -36.65 65.95 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.019 0.927 . . . . 0.0 111.727 -176.041 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.494 HD11 HG11 ' A' ' 507' ' ' VAL . 1.2 tm? -57.38 -31.34 65.7 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 113.866 -1.516 . . . . 0.0 111.277 -176.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.477 ' HD3' ' O ' ' A' ' 542' ' ' LEU . 12.4 pttt -71.65 -19.87 62.03 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -172.61 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.4 ' N ' ' HG3' ' A' ' 478' ' ' LYS . 9.0 t-160 -119.92 9.09 11.18 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 118.239 -1.384 . . . . 0.0 112.832 -171.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.498 ' HB2' HG23 ' A' ' 486' ' ' THR 0.264 1.1 pp -91.58 72.07 5.91 Favored 'General case' 0 C--O 1.194 -1.83 0 CA-C-O 122.739 1.256 . . . . 0.0 110.982 175.812 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -98.67 9.45 43.29 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 482' ' ' ARG . . . . . 0.651 ' O ' ' HG2' ' A' ' 520' ' ' GLN . 97.7 mtt180 -66.56 -97.8 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 119.946 1.248 . . . . 0.0 114.282 -171.16 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . 0.278 1.1 p30 -143.64 -84.87 0.15 Allowed 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.034 2.235 . . . . 0.0 117.034 168.354 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt -95.43 -41.3 9.05 Favored 'General case' 0 CA--C 1.485 -1.551 0 CA-C-O 121.893 0.854 . . . . 0.0 109.414 -178.382 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 485' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 489' ' ' ASN . 9.7 p-10 -51.1 -38.4 51.6 Favored 'General case' 0 C--O 1.173 -2.965 0 CA-C-N 112.683 -2.053 . . . . 0.0 109.211 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.498 HG23 ' HB2' ' A' ' 480' ' ' LEU . 3.1 m -59.05 -51.44 70.03 Favored 'General case' 0 N--CA 1.419 -1.98 0 C-N-CA 125.907 1.683 . . . . 0.0 113.343 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -66.13 -44.72 83.44 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -174.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 59.4 mt -76.33 -21.75 55.8 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.356 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 489' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 485' ' ' ASP . 57.7 t30 -65.6 -40.39 92.59 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 123.008 0.523 . . . . 0.0 109.97 -177.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -83.96 -54.31 4.96 Favored 'General case' 0 N--CA 1.425 -1.704 0 C-N-CA 119.19 -1.004 . . . . 0.0 109.749 175.844 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -58.92 -35.96 73.96 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -171.397 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -83.23 -23.14 32.89 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 121.347 0.594 . . . . 0.0 111.347 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 15.8 m -83.98 -41.67 17.06 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -175.049 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 40.0 t -101.87 161.73 3.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.361 -173.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.81 101.95 14.7 Favored 'General case' 0 CA--C 1.495 -1.169 0 CA-C-O 121.1 0.476 . . . . 0.0 111.352 177.404 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -57.99 -36.81 73.16 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.929 -176.698 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -73.74 -28.35 61.65 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -83.36 -56.64 3.64 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 121.744 0.783 . . . . 0.0 109.113 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -77.57 11.64 1.96 Allowed 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -174.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 5.1 m -52.5 99.88 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.753 0.787 . . . . 0.0 111.896 -173.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.492 ' HB3' ' CD2' ' A' ' 504' ' ' PHE . 23.2 t-20 -119.3 154.76 33.01 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 178.569 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 47.5 tp60 -58.99 -31.8 69.1 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 123.715 0.806 . . . . 0.0 110.312 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -59.01 -53.96 52.46 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 124.181 0.992 . . . . 0.0 108.685 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 504' ' ' PHE . . . . . 0.492 ' CD2' ' HB3' ' A' ' 501' ' ' ASN . 22.0 m-85 -66.42 -35.1 79.47 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.425 -178.209 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -64.36 -49.34 72.01 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 123.199 0.599 . . . . 0.0 110.269 -176.83 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.53 ' O ' HG23 ' A' ' 510' ' ' VAL . 9.2 m-85 -60.09 -54.87 40.81 Favored 'General case' 0 N--CA 1.439 -0.991 0 O-C-N 123.855 0.722 . . . . 0.0 111.953 178.477 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 507' ' ' VAL . . . . . 0.494 HG11 HD11 ' A' ' 477' ' ' LEU . 54.5 t -60.48 -48.04 90.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.349 -176.961 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -49.69 -50.31 44.19 Favored 'General case' 0 C--O 1.218 -0.567 0 O-C-N 123.568 0.543 . . . . 0.0 111.117 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -63.46 -53.73 47.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 506' ' ' TYR . 42.8 t -57.96 -45.95 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 121.217 0.532 . . . . 0.0 110.407 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 507' ' ' VAL . 0.4 OUTLIER -66.4 -48.66 69.36 Favored 'General case' 0 N--CA 1.419 -2.001 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.976 -176.352 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -60.01 -42.96 95.45 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.152 0.581 . . . . 0.0 110.651 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -71.15 -43.34 67.73 Favored 'General case' 0 C--N 1.313 -0.991 0 O-C-N 123.405 0.441 . . . . 0.0 112.179 -173.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 514' ' ' PHE . . . . . 0.412 ' HA ' ' HG2' ' A' ' 517' ' ' GLU . 65.1 m-85 -73.92 -42.16 61.02 Favored 'General case' 0 C--O 1.199 -1.605 0 C-N-CA 119.289 -0.964 . . . . 0.0 111.607 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -54.74 -32.06 59.24 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.454 0.701 . . . . 0.0 110.311 176.702 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -70.23 -24.37 63.08 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.409 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.412 ' HG2' ' HA ' ' A' ' 514' ' ' PHE . 10.0 pt-20 -110.03 -44.05 3.86 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -176.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 518' ' ' ASN . . . . . 0.408 ' HB3' ' H ' ' A' ' 519' ' ' ASP . 92.1 m-20 -135.38 -152.16 0.45 Allowed 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 124.355 1.062 . . . . 0.0 109.592 -172.622 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 519' ' ' ASP . . . . . 0.408 ' H ' ' HB3' ' A' ' 518' ' ' ASN . 3.4 p-10 -79.32 -164.54 0.64 Allowed 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 125.093 1.357 . . . . 0.0 111.683 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 520' ' ' GLN . . . . . 0.651 ' HG2' ' O ' ' A' ' 482' ' ' ARG . 0.0 OUTLIER -73.78 -178.79 3.33 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 115.933 1.827 . . . . 0.0 115.933 -171.227 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 521' ' ' TYR . . . . . 0.433 ' CB ' ' HG ' ' A' ' 511' ' ' LEU . 12.0 t80 -103.21 138.03 40.56 Favored 'General case' 1 N--CA 1.362 -4.863 0 C-N-CA 125.384 1.473 . . . . 0.0 107.49 -177.321 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -118.99 167.79 11.42 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.6 pp -70.36 -8.63 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 121.512 0.672 . . . . 0.0 110.726 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 12.8 m -56.19 -40.47 74.01 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.787 173.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -71.41 -40.51 70.42 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -59.29 -48.11 82.86 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.878 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.672 ' O ' HG12 ' A' ' 530' ' ' VAL . 10.3 p -67.65 -28.55 42.19 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.854 0 CA-C-O 121.314 0.578 . . . . 0.0 110.71 177.463 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -70.7 -20.77 62.64 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.6 ' O ' ' HG2' ' A' ' 536' ' ' ARG . 2.0 m-85 -74.57 -23.41 58.76 Favored 'General case' 0 CA--C 1.494 -1.184 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.672 HG12 ' O ' ' A' ' 527' ' ' VAL . 10.0 p -74.03 52.57 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.898 0 CA-C-O 123.226 1.488 . . . . 0.0 114.839 -171.932 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -107.64 -34.14 7.09 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 173.483 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.54 144.79 25.43 Favored 'General case' 0 N--CA 1.424 -1.737 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 171.198 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . 0.257 7.2 p30 -76.34 -69.0 0.53 Allowed 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 -168.339 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 534' ' ' GLU . . . . . 0.401 ' CD ' ' H ' ' A' ' 535' ' ' LEU 0.258 0.0 OUTLIER -50.24 -73.16 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 117.479 2.4 . . . . 0.0 117.479 -164.911 . . . . . . . . 4 4 . 1 . 006 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.401 ' H ' ' CD ' ' A' ' 534' ' ' GLU . 58.8 tp -71.91 -31.98 66.94 Favored 'General case' 0 C--N 1.28 -2.453 0 CA-C-O 121.646 0.736 . . . . 0.0 111.236 -172.075 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 529' ' ' TYR . 8.2 mpt_? -75.02 -44.0 50.48 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.34 -173.741 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -60.73 -40.21 91.5 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.31 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.465 ' O ' HD13 ' A' ' 542' ' ' LEU . 57.2 m -54.38 -49.14 70.56 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.908 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 539' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 539' ' ' LEU . 4.1 mm? -59.17 -38.24 79.29 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 49.9 mm -68.29 -40.67 82.93 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 35.2 t -58.47 -45.46 88.61 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.696 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.477 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 6.8 mp -64.78 -30.08 71.07 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.959 177.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 543' ' ' GLU . . . . . 0.457 ' HA ' ' CD ' ' A' ' 478' ' ' LYS . 0.2 OUTLIER -76.29 -34.4 59.09 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 177.893 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -62.67 -36.11 81.83 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.374 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -67.67 113.39 5.42 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 172.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -134.52 103.08 5.54 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-O 121.962 0.887 . . . . 0.0 111.929 -178.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.427 ' HG ' ' ND2' ' A' ' 554' ' ' ASN . 40.8 tp -91.85 -12.54 33.36 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.591 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -70.1 18.94 0.05 OUTLIER 'General case' 0 CA--C 1.559 1.31 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 -173.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -68.76 -31.39 70.39 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.65 0.738 . . . . 0.0 112.11 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.483 ' HB2' ' HD2' ' A' ' 551' ' ' PRO . 12.5 pt-20 -95.71 -178.97 0.84 Allowed Pre-proline 0 C--N 1.3 -1.582 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 551' ' ' PRO . . . . . 0.483 ' HD2' ' HB2' ' A' ' 550' ' ' GLU . 83.9 Cg_exo -47.6 137.85 19.89 Favored 'Trans proline' 0 C--N 1.386 2.527 0 C-N-CA 121.811 1.674 . . . . 0.0 110.299 175.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -74.01 4.73 5.04 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 121.908 0.861 . . . . 0.0 112.866 -167.948 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 553' ' ' GLU . . . . . 0.473 ' HA ' HG12 ' A' ' 556' ' ' ILE . 1.9 mp0 -74.94 -12.6 60.39 Favored 'General case' 0 N--CA 1.408 -2.565 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.859 176.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 554' ' ' ASN . . . . . 0.427 ' ND2' ' HG ' ' A' ' 547' ' ' LEU . 28.0 p-10 -69.75 -24.4 63.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -80.34 -56.38 4.24 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -177.304 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 556' ' ' ILE . . . . . 0.473 HG12 ' HA ' ' A' ' 553' ' ' GLU . 34.0 pt -64.69 -38.24 82.16 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.87 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 557' ' ' ASP . . . . . 0.401 ' HA ' HG12 ' A' ' 560' ' ' VAL . 36.2 t70 -63.94 -45.08 90.77 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -65.37 -45.78 82.73 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -56.22 -52.58 63.92 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 113.985 -1.461 . . . . 0.0 111.291 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 560' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 556' ' ' ILE . 13.2 p -65.94 -36.01 76.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.353 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.515 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 27.3 t-20 -62.55 -32.73 73.73 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.349 0.595 . . . . 0.0 110.232 176.529 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 70.2 t -77.35 -56.94 6.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 CA-C-N 115.553 -0.748 . . . . 0.0 112.522 175.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 563' ' ' ILE . . . . . . . . . . . . . 50.7 mm -74.77 -49.74 28.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.418 -169.301 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -80.78 -3.29 50.45 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.575 -174.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 29.4 tt0 -64.11 -32.75 74.43 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 168.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 64.7 mttm . . . . . 0 C--N 1.317 -0.838 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.046 174.754 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 82.1 mt . . . . . 0 N--CA 1.434 -1.238 0 CA-C-O 121.572 0.701 . . . . 0.0 110.529 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.7 m -106.12 -170.71 1.77 Allowed 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.187 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 468' ' ' ARG . . . . . 0.426 ' O ' ' HB3' ' A' ' 471' ' ' LYS . 39.0 ttm180 -58.22 -24.17 58.29 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.199 1.0 . . . . 0.0 111.24 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.535 ' NE2' ' HB2' ' A' ' 566' ' ' LYS . 20.9 mp0 -60.11 -24.84 64.98 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.813 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.423 ' O ' ' HB2' ' A' ' 474' ' ' ARG . 8.3 tm-20 -66.48 -34.71 78.55 Favored 'General case' 0 C--O 1.206 -1.227 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.62 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 468' ' ' ARG . 13.3 tmtt? -66.36 -39.64 89.28 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.327 176.659 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 472' ' ' ALA . . . . . 0.4 ' HB2' HG11 ' A' ' 562' ' ' VAL . . . -63.37 -49.3 74.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.839 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 473' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 469' ' ' GLN . 36.6 mt-10 -67.71 -34.55 77.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.853 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 470' ' ' GLU . 37.2 ttp180 -61.08 -45.55 94.26 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 123.987 0.915 . . . . 0.0 109.681 175.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 475' ' ' ALA . . . . . 0.462 ' HA ' HD23 ' A' ' 542' ' ' LEU . . . -68.3 -41.83 80.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.74 -179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -60.03 -51.06 71.25 Favored 'General case' 0 C--O 1.24 0.589 0 O-C-N 123.677 0.611 . . . . 0.0 110.27 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.511 HD21 HG11 ' A' ' 507' ' ' VAL . 1.6 tt -57.8 -38.91 76.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.623 -1.171 . . . . 0.0 111.861 178.366 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.433 ' HB2' HD11 ' A' ' 539' ' ' LEU . 23.7 tptp -82.39 -13.94 56.01 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.714 -175.216 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.412 ' CE1' ' HB2' ' A' ' 552' ' ' TYR . 6.4 t60 -85.79 -53.86 4.87 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.325 -172.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.597 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 96.0 mt -101.71 107.69 18.99 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 121.766 0.793 . . . . 0.0 112.719 -173.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 53.1 mtt -94.74 -44.0 7.99 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.766 -174.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 482' ' ' ARG . . . . . 0.458 ' HG2' ' OE1' ' A' ' 520' ' ' GLN . 99.2 mtt180 -70.03 -31.14 68.64 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 122.378 1.085 . . . . 0.0 110.848 -179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 483' ' ' ASP . . . . . 0.597 ' HB2' ' HB3' ' A' ' 480' ' ' LEU . 4.7 m-20 -70.63 61.01 0.23 Allowed 'General case' 0 C--N 1.252 -3.653 0 C-N-CA 127.496 2.318 . . . . 0.0 116.83 -170.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 484' ' ' LYS . . . . . 0.565 ' HD3' ' OD2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -39.66 -41.51 1.07 Allowed 'General case' 0 N--CA 1.52 3.06 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 172.329 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -52.21 -52.93 49.32 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.053 0.941 . . . . 0.0 110.77 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.5 ' O ' ' HB3' ' A' ' 490' ' ' TYR . 68.0 m -64.14 -35.79 81.93 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.514 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -51.21 -54.07 29.13 Favored 'General case' 0 C--N 1.349 0.578 0 O-C-N 123.12 0.263 . . . . 0.0 110.634 177.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -78.54 -33.23 48.02 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 119.237 -0.985 . . . . 0.0 112.064 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.37 -32.83 74.02 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.176 0.512 . . . . 0.0 110.743 -176.185 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 490' ' ' TYR . . . . . 0.5 ' HB3' ' O ' ' A' ' 486' ' ' THR . 0.0 OUTLIER -86.59 -45.44 11.04 Favored 'General case' 0 N--CA 1.389 -3.513 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.954 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -56.12 -39.38 72.14 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -70.52 -25.15 62.99 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.505 0.669 . . . . 0.0 110.079 -176.621 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 23.1 m -90.01 -16.59 29.5 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 123.548 0.739 . . . . 0.0 112.641 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 494' ' ' VAL . . . . . 0.495 HG21 ' CE2' ' A' ' 490' ' ' TYR . 79.5 t -117.95 144.7 25.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -166.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 495' ' ' ASP . . . . . 0.517 ' OD2' ' HA ' ' A' ' 500' ' ' THR . 12.7 t70 71.49 -36.75 0.37 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 117.017 2.228 . . . . 0.0 117.017 167.557 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -41.8 -67.52 0.25 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -166.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . 0.264 8.6 m-20 -80.92 -73.22 0.38 Allowed 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 -175.419 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -101.41 -37.05 8.62 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -172.108 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -76.25 11.14 1.63 Allowed 'General case' 0 CA--C 1.56 1.351 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -173.512 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 500' ' ' THR . . . . . 0.517 ' HA ' ' OD2' ' A' ' 495' ' ' ASP . 25.7 m -53.68 105.74 0.15 Allowed 'General case' 0 C--O 1.249 1.059 0 C-N-CA 124.35 1.06 . . . . 0.0 113.639 -173.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -124.4 125.01 43.57 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 177.606 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -59.86 -9.04 2.53 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -171.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 503' ' ' HIS . . . . . 0.454 ' HB2' HD22 ' A' ' 535' ' ' LEU . 8.8 t-80 -58.97 -49.54 77.49 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 172.431 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -63.95 -38.16 90.06 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.863 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -63.44 -50.24 70.53 Favored 'General case' 0 CA--C 1.501 -0.914 0 O-C-N 123.612 0.57 . . . . 0.0 109.63 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.448 ' O ' HG23 ' A' ' 510' ' ' VAL . 14.7 m-85 -56.61 -46.01 81.14 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.367 -178.589 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 507' ' ' VAL . . . . . 0.535 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 21.6 t -73.84 -46.37 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.541 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.844 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -51.72 -43.04 62.69 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 117.956 0.344 . . . . 0.0 111.647 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -57.09 -50.18 73.58 Favored 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 123.922 0.764 . . . . 0.0 109.135 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 506' ' ' TYR . 48.6 t -61.1 -51.12 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.666 175.844 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 95.5 mt -53.04 -51.03 63.06 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.763 -175.301 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -71.36 -32.7 68.81 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.977 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -66.74 -49.91 64.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.888 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 514' ' ' PHE . . . . . 0.416 ' CD2' HG12 ' A' ' 510' ' ' VAL 0.282 1.0 OUTLIER -71.3 -26.53 62.9 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.28 177.312 . . . . . . . . 4 4 . 1 . 007 nuclear build core ' A' A ' 515' ' ' TYR . . . . . 0.653 ' HA ' ' HB3' ' A' ' 519' ' ' ASP . 23.4 t80 -52.16 -41.17 62.37 Favored 'General case' 0 C--N 1.347 0.475 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 175.831 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -72.19 -15.06 61.95 Favored 'General case' 0 CA--C 1.555 1.153 0 CA-C-N 114.189 -1.368 . . . . 0.0 114.015 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -120.92 -57.25 1.89 Allowed 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -172.377 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -153.48 105.28 2.82 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 103.901 -2.629 . . . . 0.0 103.901 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 519' ' ' ASP . . . . . 0.653 ' HB3' ' HA ' ' A' ' 515' ' ' TYR . 8.0 p-10 -106.01 91.35 3.7 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 117.341 2.349 . . . . 0.0 117.341 -165.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 520' ' ' GLN . . . . . 0.458 ' OE1' ' HG2' ' A' ' 482' ' ' ARG . 25.2 mt-30 -145.06 158.45 43.81 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 126.707 2.003 . . . . 0.0 106.389 158.141 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -80.52 124.49 28.99 Favored 'General case' 0 N--CA 1.424 -1.747 0 CA-C-N 119.958 1.253 . . . . 0.0 108.668 176.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -107.68 148.31 29.55 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 42.2 pt -83.14 -14.98 11.75 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 122.951 0.5 . . . . 0.0 111.233 -175.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.617 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 42.4 p -57.16 -41.42 79.18 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.415 0.626 . . . . 0.0 109.501 176.32 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 525' ' ' ASP . . . . . 0.419 ' CG ' HG11 ' A' ' 510' ' ' VAL . 24.5 t70 -58.26 -49.62 76.47 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.17 177.441 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.404 ' HA ' ' HD2' ' A' ' 536' ' ' ARG . . . -59.83 -49.01 79.38 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.256 -178.311 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.627 ' O ' HG12 ' A' ' 530' ' ' VAL . 7.8 p -65.99 -29.29 46.37 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 528' ' ' GLN . . . . . 0.617 ' HG3' ' O ' ' A' ' 524' ' ' SER . 94.2 mt-30 -67.57 -43.5 80.44 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.751 0.786 . . . . 0.0 109.089 175.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.408 ' HB2' ' HG2' ' A' ' 536' ' ' ARG . 27.4 m-85 -78.59 4.51 13.29 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.627 HG12 ' O ' ' A' ' 527' ' ' VAL . 8.8 p -83.02 -2.4 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.977 -176.424 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -105.06 -15.23 15.15 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.415 1.103 . . . . 0.0 108.544 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 532' ' ' SER . . . . . 0.411 ' C ' ' H ' ' A' ' 534' ' ' GLU . 37.0 t -95.99 -143.16 0.27 Allowed 'General case' 0 C--N 1.296 -1.754 0 C-N-CA 127.574 2.35 . . . . 0.0 108.821 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 533' ' ' ASN . . . . . 0.49 ' O ' ' N ' ' A' ' 535' ' ' LEU . 7.8 p30 -29.97 30.05 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.363 1 C-N-CA 137.252 6.221 . . . . 0.0 116.916 171.515 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 534' ' ' GLU . . . . . 0.424 ' C ' ' H ' ' A' ' 537' ' ' GLU . 10.0 pt-20 -30.83 10.67 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.708 1 C-N-CA 133.034 4.534 . . . . 0.0 117.962 -173.963 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.524 ' H ' HD12 ' A' ' 535' ' ' LEU . 4.3 mp -69.41 -23.92 63.78 Favored 'General case' 0 C--N 1.278 -2.514 0 N-CA-C 102.566 -3.124 . . . . 0.0 102.566 160.346 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.471 ' O ' HG12 ' A' ' 540' ' ' ILE . 5.6 tpp180 -68.24 -29.44 68.25 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 112.214 -2.266 . . . . 0.0 110.274 171.806 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 537' ' ' GLU . . . . . 0.424 ' H ' ' C ' ' A' ' 534' ' ' GLU . 2.2 tm-20 -71.77 -40.14 69.49 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 -178.707 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.412 ' O ' ' HB2' ' A' ' 541' ' ' SER . 24.4 m -58.69 -43.4 89.96 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 170.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 539' ' ' LEU . . . . . 0.433 HD11 ' HB2' ' A' ' 478' ' ' LYS . 22.6 tp -59.72 -36.5 76.68 Favored 'General case' 0 CA--C 1.56 1.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.762 177.327 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 540' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 536' ' ' ARG . 35.3 mm -64.03 -37.96 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.506 0.722 . . . . 0.0 109.974 176.085 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 541' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 538' ' ' THR . 21.5 m -56.81 -39.11 73.55 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 121.122 0.487 . . . . 0.0 110.22 174.17 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' A' ' 475' ' ' ALA . 9.5 mp -66.51 -30.31 70.6 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.408 175.046 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -65.04 -45.13 86.7 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 175.812 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -75.59 45.99 0.34 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.195 174.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -50.86 136.57 22.22 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 125.024 1.33 . . . . 0.0 110.084 -177.003 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 546' ' ' ASN . . . . . 0.424 ' C ' ' H ' ' A' ' 548' ' ' ASN . 12.2 t30 -83.75 179.67 7.53 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.942 -172.335 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.492 ' C ' ' H ' ' A' ' 549' ' ' ASP . 3.1 mm? -70.01 23.63 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.317 1.847 . . . . 0.0 113.851 -174.144 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 548' ' ' ASN . . . . . 0.424 ' H ' ' C ' ' A' ' 546' ' ' ASN . 17.4 m120 -75.45 24.75 0.11 Allowed 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 127.095 2.158 . . . . 0.0 110.208 174.563 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 549' ' ' ASP . . . . . 0.492 ' H ' ' C ' ' A' ' 547' ' ' LEU . 11.0 m-20 -58.88 32.72 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 127.97 2.508 . . . . 0.0 117.493 -172.276 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -74.68 160.05 81.86 Favored Pre-proline 0 C--N 1.3 -1.563 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -37.4 130.36 0.66 Allowed 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 123.562 2.841 . . . . 0.0 111.233 178.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 552' ' ' TYR . . . . . 0.412 ' HB2' ' CE1' ' A' ' 479' ' ' HIS . 31.3 p90 -73.37 -6.98 49.68 Favored 'General case' 0 CA--C 1.495 -1.155 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -167.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 59.0 mp0 -71.36 -1.08 11.73 Favored 'General case' 0 C--N 1.291 -1.944 0 C-N-CA 124.256 1.023 . . . . 0.0 111.527 174.798 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -62.73 -21.57 65.9 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 123.827 0.851 . . . . 0.0 108.887 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 555' ' ' GLU . . . . . 0.476 ' HG3' HG13 ' A' ' 556' ' ' ILE . 13.5 pt-20 -48.27 -62.96 1.22 Allowed 'General case' 0 C--O 1.215 -0.763 0 C-N-CA 124.58 1.152 . . . . 0.0 113.93 -177.207 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 556' ' ' ILE . . . . . 0.476 HG13 ' HG3' ' A' ' 555' ' ' GLU . 16.8 mt -66.39 -36.78 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-O 120.87 0.367 . . . . 0.0 110.14 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -56.98 -52.02 66.89 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.787 177.417 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 558' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 562' ' ' VAL . 32.8 t70 -66.94 -49.97 63.82 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.278 178.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -49.75 -53.57 24.18 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.17 1.788 . . . . 0.0 111.655 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 65.4 t -63.21 -47.93 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.625 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -60.14 -41.61 93.07 Favored 'General case' 0 C--O 1.201 -1.458 0 O-C-N 123.069 0.231 . . . . 0.0 111.275 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 562' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 558' ' ' ASP . 69.9 t -62.74 -37.3 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-O 121.403 0.62 . . . . 0.0 111.708 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.458 ' HA ' ' CG ' ' A' ' 469' ' ' GLN . 54.6 mt -87.24 -39.8 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.916 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.306 -173.505 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -81.93 -14.98 55.34 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.01 -174.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -71.95 -13.06 61.53 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.47 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 566' ' ' LYS . . . . . 0.535 ' HB2' ' NE2' ' A' ' 469' ' ' GLN . 63.0 tttm . . . . . 0 N--CA 1.466 0.36 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.612 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.6 mm? . . . . . 0 N--CA 1.412 -2.327 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.8 m -57.04 107.37 0.4 Allowed 'General case' 0 C--N 1.289 -2.036 0 O-C-N 124.278 0.986 . . . . 0.0 113.012 -174.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 4.9 ptm85 -65.2 -22.89 66.95 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 177.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.68 ' NE2' ' HB3' ' A' ' 566' ' ' LYS . 97.4 mt-30 -66.3 -32.15 73.38 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 174.247 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.645 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 3.2 tm-20 -71.24 -28.47 64.2 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.41 ' HA ' ' CD ' ' A' ' 474' ' ' ARG . 12.8 tmtt? -66.69 -35.42 80.1 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.513 176.286 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.47 99.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.157 0.504 . . . . 0.0 109.72 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -66.35 -35.6 80.75 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.92 177.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.645 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 90.8 mtt180 -57.24 -43.29 82.78 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 175.615 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 475' ' ' ALA . . . . . 0.467 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -66.19 -48.36 70.93 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.477 178.026 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.94 -8.31 6.91 Favored 'General case' 0 C--O 1.25 1.129 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 178.512 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.681 ' O ' ' HG ' ' A' ' 480' ' ' LEU . 1.0 OUTLIER -55.83 -27.87 53.52 Favored 'General case' 0 C--O 1.21 -1.025 0 O-C-N 122.053 -0.404 . . . . 0.0 111.314 174.824 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 47.8 pttt -56.83 -7.96 0.53 Allowed 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 124.486 1.114 . . . . 0.0 112.495 176.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.552 ' CD2' ' HA ' ' A' ' 487' ' ' PHE . 24.1 p-80 -52.95 -31.24 39.38 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.312 1.045 . . . . 0.0 110.335 177.319 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.681 ' HG ' ' O ' ' A' ' 477' ' ' LEU . 1.9 pp -71.99 5.75 2.5 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.524 1.129 . . . . 0.0 113.221 -173.134 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 92.8 mmm -94.38 -27.57 15.99 Favored 'General case' 0 N--CA 1.42 -1.954 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.014 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 482' ' ' ARG . . . . . 0.588 ' HB3' ' OG1' ' A' ' 486' ' ' THR . 40.0 ttt180 -78.18 -98.57 0.02 OUTLIER 'General case' 0 C--N 1.367 1.338 0 C-N-CA 117.79 -1.564 . . . . 0.0 109.71 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -145.35 -94.65 0.1 Allowed 'General case' 0 C--N 1.385 2.14 0 C-N-CA 113.462 -3.295 . . . . 0.0 117.752 161.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -101.2 -43.75 5.89 Favored 'General case' 0 CA--C 1.482 -1.664 0 CA-C-O 122.718 1.247 . . . . 0.0 112.183 174.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 485' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' A' ' 489' ' ' ASN . 5.8 p-10 -54.16 -43.19 70.41 Favored 'General case' 0 CA--C 1.483 -1.602 0 CA-C-N 112.507 -2.133 . . . . 0.0 109.911 -175.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.588 ' OG1' ' HB3' ' A' ' 482' ' ' ARG . 2.7 m -67.4 -35.34 79.1 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.336 -174.424 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 487' ' ' PHE . . . . . 0.552 ' HA ' ' CD2' ' A' ' 479' ' ' HIS . 49.1 t80 -62.59 -55.67 25.02 Favored 'General case' 0 CA--C 1.496 -1.113 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.897 178.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 2.0 tp -75.63 -22.98 56.34 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.809 -176.783 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 489' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 485' ' ' ASP . 5.4 t30 -63.23 -47.01 84.27 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -176.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.33 -32.8 24.1 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.163 -1.015 . . . . 0.0 111.53 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -69.93 -38.02 76.09 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 123.408 0.683 . . . . 0.0 112.16 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -79.93 -30.16 39.88 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 120.906 0.384 . . . . 0.0 110.981 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 36.5 m -77.99 -40.41 39.23 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.577 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.8 t -99.72 100.02 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 CA-C-O 121.859 0.838 . . . . 0.0 109.436 -177.473 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -87.09 21.06 2.45 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.556 -176.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.453 ' NZ ' ' HB3' ' A' ' 496' ' ' LYS . 1.5 ttpm? -90.13 18.02 6.36 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -64.03 -20.44 65.92 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 124.79 1.236 . . . . 0.0 113.953 -171.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -82.33 -21.49 35.99 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.32 0.581 . . . . 0.0 110.492 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -79.79 -25.45 40.91 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.08 -179.134 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 3.3 m -67.3 140.03 57.29 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.91 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.03 175.75 2.99 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 124.841 1.256 . . . . 0.0 112.54 -176.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 502' ' ' GLN . . . . . 0.434 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -57.42 -19.69 25.22 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.626 1.17 . . . . 0.0 112.261 -178.211 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 503' ' ' HIS . . . . . 0.462 ' O ' HG23 ' A' ' 507' ' ' VAL . 17.1 t-160 -55.97 -40.01 72.64 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 125.146 1.378 . . . . 0.0 109.228 177.889 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 504' ' ' PHE . . . . . 0.541 ' O ' ' HD1' ' A' ' 508' ' ' PHE . 55.3 t80 -57.74 -53.16 61.31 Favored 'General case' 0 C--O 1.203 -1.365 0 C-N-CA 125.572 1.549 . . . . 0.0 108.619 177.247 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.434 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 72.5 tttt -57.93 -43.3 86.18 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 125.771 1.629 . . . . 0.0 111.923 -173.488 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -61.49 -56.11 23.72 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.49 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 507' ' ' VAL . . . . . 0.564 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 3.2 t -67.48 -46.99 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.705 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.808 -174.764 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 508' ' ' PHE . . . . . 0.541 ' HD1' ' O ' ' A' ' 504' ' ' PHE . 59.2 m-85 -55.3 -34.6 64.29 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 178.181 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -60.76 -52.43 65.14 Favored 'General case' 0 C--O 1.256 1.41 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 176.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 17.9 t -63.29 -46.26 96.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.898 177.992 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 93.5 mt -59.76 -49.28 78.34 Favored 'General case' 0 C--O 1.206 -1.198 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.545 -176.317 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -66.36 -28.7 68.85 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.737 0.303 . . . . 0.0 110.352 -177.394 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -70.44 -27.75 64.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.194 0.521 . . . . 0.0 110.249 177.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -83.07 -42.42 17.46 Favored 'General case' 0 CA--C 1.481 -1.677 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 175.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -50.24 -24.91 3.17 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.663 1.185 . . . . 0.0 111.349 176.779 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -52.71 -35.63 56.01 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 173.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -108.81 -61.32 1.63 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 119.62 -0.832 . . . . 0.0 109.482 173.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -159.14 135.71 9.3 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -75.84 97.01 3.8 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 120.47 1.486 . . . . 0.0 108.756 177.731 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -137.51 94.88 2.98 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.43 -176.424 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 521' ' ' TYR . . . . . 0.568 ' CE2' ' HB2' ' A' ' 526' ' ' ALA . 0.1 OUTLIER -58.45 143.63 44.82 Favored 'General case' 0 N--CA 1.401 -2.896 0 CA-C-O 121.604 0.716 . . . . 0.0 112.101 173.715 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -118.45 135.02 54.61 Favored 'General case' 0 C--N 1.285 -2.234 0 N-CA-C 105.14 -2.171 . . . . 0.0 105.14 173.315 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 523' ' ' ILE . . . . . 0.426 ' O ' HG12 ' A' ' 527' ' ' VAL . 3.9 tp -53.68 -34.47 24.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 O-C-N 123.659 0.599 . . . . 0.0 112.032 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 28.9 t -55.36 -48.86 73.61 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 122.977 0.511 . . . . 0.0 111.01 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.04 -42.85 99.61 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.89 0.852 . . . . 0.0 110.255 178.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.568 ' HB2' ' CE2' ' A' ' 521' ' ' TYR . . . -58.74 -52.99 63.33 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.788 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.426 HG12 ' O ' ' A' ' 523' ' ' ILE . 14.1 p -70.36 -36.23 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.924 0 C-N-CA 123.366 0.666 . . . . 0.0 111.998 -177.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -71.67 -12.95 61.59 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 121.074 -1.016 . . . . 0.0 110.651 177.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.63 ' HB3' ' HG3' ' A' ' 536' ' ' ARG . 0.0 OUTLIER -76.52 -3.91 39.89 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.991 173.229 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 530' ' ' VAL . . . . . . . . . . . . . 4.7 p -72.88 22.57 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.573 1.83 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -176.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -70.41 -34.96 73.12 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 121.186 -0.946 . . . . 0.0 108.635 174.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 23.1 t -91.42 111.04 22.37 Favored 'General case' 0 N--CA 1.42 -1.939 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 170.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -61.4 -60.98 2.88 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.098 -174.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -56.31 -46.58 79.78 Favored 'General case' 0 C--O 1.244 0.794 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.62 -174.811 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.59 -56.5 9.18 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.002 -173.069 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.63 ' HG3' ' HB3' ' A' ' 529' ' ' TYR . 2.3 mmt180 -72.4 -28.24 62.86 Favored 'General case' 0 N--CA 1.419 -2.018 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.45 -52.44 65.36 Favored 'General case' 0 C--O 1.251 1.174 0 CA-C-N 119.261 0.937 . . . . 0.0 110.002 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 541' ' ' SER . 1.9 p -63.93 -46.08 86.36 Favored 'General case' 0 N--CA 1.425 -1.689 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.284 177.55 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 19.0 tp -62.82 -32.89 74.18 Favored 'General case' 0 CA--C 1.56 1.341 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 540' ' ' ILE . . . . . 0.432 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 55.9 mt -66.94 -38.42 81.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 173.218 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 541' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 538' ' ' THR . 50.0 m -57.28 -38.54 74.08 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.047 172.658 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.615 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 3.9 mm? -71.78 -27.3 62.85 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 173.352 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -61.83 -56.09 23.11 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 174.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 544' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 540' ' ' ILE . 28.1 pt20 -80.21 13.25 2.42 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.665 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 545' ' ' TYR . . . . . 0.615 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 2.9 t80 -66.26 118.33 9.81 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.655 0.741 . . . . 0.0 110.93 177.524 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -94.03 120.62 34.54 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.714 -175.382 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.669 ' H ' HD13 ' A' ' 547' ' ' LEU . 0.0 OUTLIER -83.15 7.15 16.89 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -177.228 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -81.93 -21.13 37.46 Favored 'General case' 0 C--N 1.312 -1.049 0 O-C-N 121.304 -0.873 . . . . 0.0 109.799 175.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -69.31 -67.55 0.47 Allowed 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -86.5 111.65 40.9 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 167.485 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -50.1 146.61 17.13 Favored 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 123.464 2.776 . . . . 0.0 114.579 -170.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -73.97 -2.92 26.12 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 122.145 0.974 . . . . 0.0 111.043 -173.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -81.97 -41.59 20.56 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.518 170.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -73.07 -22.05 60.67 Favored 'General case' 0 C--O 1.185 -2.316 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -24.71 -70.3 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 126.629 1.972 . . . . 0.0 113.428 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 53.2 mt -68.46 -47.88 75.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.82 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -59.29 -48.89 79.92 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.097 -0.956 . . . . 0.0 113.026 -175.59 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -66.46 -51.39 57.31 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 124.084 0.953 . . . . 0.0 110.638 -177.549 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -51.58 -52.13 49.88 Favored 'General case' 0 C--O 1.246 0.872 0 C-N-CA 124.157 0.983 . . . . 0.0 110.474 176.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 95.0 t -66.91 -40.16 85.12 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.738 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -58.73 -39.4 80.77 Favored 'General case' 0 C--O 1.196 -1.757 0 C-N-CA 122.993 0.517 . . . . 0.0 110.637 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 562' ' ' VAL . . . . . 0.434 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 47.2 t -66.32 -36.59 77.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.418 0.628 . . . . 0.0 111.873 177.169 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.547 ' HA ' ' HG2' ' A' ' 469' ' ' GLN . 49.6 mt -78.67 -43.93 25.68 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 CA-C-O 121.738 0.78 . . . . 0.0 109.678 -177.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -77.94 -6.55 54.75 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.152 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.434 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 29.2 tt0 -61.74 -45.58 93.31 Favored 'General case' 0 CA--C 1.49 -1.346 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 175.109 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 566' ' ' LYS . . . . . 0.68 ' HB3' ' NE2' ' A' ' 469' ' ' GLN . 59.4 tttm . . . . . 0 C--N 1.303 -1.449 0 CA-C-O 122.554 1.168 . . . . 0.0 108.129 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 98.9 mt . . . . . 0 N--CA 1.437 -1.09 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 17.0 m -58.9 136.72 57.95 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 114.021 -1.445 . . . . 0.0 114.298 -171.113 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -65.83 -32.78 74.5 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.911 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.487 ' HG2' ' HA ' ' A' ' 563' ' ' ILE . 97.3 mt-30 -64.28 -41.85 96.69 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 175.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 5.8 tm-20 -63.34 -29.05 70.42 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.287 178.335 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.414 ' HD3' ' HA ' ' A' ' 471' ' ' LYS . 25.9 mmtm -66.34 -37.86 86.32 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.555 171.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.44 -36.96 71.44 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.118 -177.998 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 473' ' ' GLU . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 504' ' ' PHE . 0.9 OUTLIER -57.94 -40.81 81.4 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 123.327 0.392 . . . . 0.0 110.777 171.863 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 93.4 mtt180 -62.37 -42.81 99.7 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 177.285 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -67.44 -29.88 69.47 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.058 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -66.03 -33.58 76.12 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.68 0.752 . . . . 0.0 109.875 177.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 87.3 mt -76.52 10.57 2.03 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.446 177.729 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.437 ' HE3' ' CD2' ' A' ' 545' ' ' TYR . 18.9 tptm -59.88 -10.62 4.18 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.433 1.093 . . . . 0.0 112.989 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -74.76 142.03 44.35 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.908 -0.495 . . . . 0.0 111.424 -176.144 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.733 ' H ' HD13 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -75.66 -150.77 0.03 OUTLIER 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.792 175.252 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 481' ' ' MET . . . . . 0.465 ' C ' ' H ' ' A' ' 483' ' ' ASP . 66.8 mtt -50.4 -9.88 0.05 Allowed 'General case' 0 N--CA 1.516 2.851 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 -177.411 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -72.92 7.12 2.18 Favored 'General case' 0 CA--C 1.561 1.386 0 C-N-CA 125.185 1.394 . . . . 0.0 109.518 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 483' ' ' ASP . . . . . 0.465 ' H ' ' C ' ' A' ' 481' ' ' MET . 5.5 p-10 -70.41 -10.96 60.52 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 125.701 1.6 . . . . 0.0 113.65 -170.178 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -63.02 -44.63 95.44 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.738 0.78 . . . . 0.0 109.649 176.086 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.61 -51.67 66.38 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 114.726 -1.124 . . . . 0.0 109.649 178.428 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 59.0 m -61.81 -40.64 95.95 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 114.561 -1.199 . . . . 0.0 111.995 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 487' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 23.1 t80 -56.57 -53.28 59.4 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 122.394 0.278 . . . . 0.0 110.734 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.437 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 65.8 mt -72.73 -25.46 61.22 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.588 -178.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -69.23 -39.85 78.28 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.636 0.731 . . . . 0.0 110.085 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.79 -21.48 26.47 Favored 'General case' 0 N--CA 1.424 -1.737 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.326 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 491' ' ' TYR . . . . . 0.549 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.3 OUTLIER -67.03 -41.24 86.94 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 123.801 0.84 . . . . 0.0 109.332 178.878 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 492' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 8.9 pt-20 -77.92 -46.32 21.6 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -176.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 27.5 p -89.98 -28.65 18.98 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -170.435 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 47.0 t -91.2 162.7 2.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 O-C-N 122.012 -0.43 . . . . 0.0 111.187 -170.297 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -75.09 109.82 8.88 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 121.896 0.855 . . . . 0.0 111.05 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -88.9 -25.02 22.34 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.143 -1.389 . . . . 0.0 108.715 176.752 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -86.75 -66.57 0.89 Allowed 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 118.845 2.906 . . . . 0.0 118.845 -166.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -107.27 -34.15 7.19 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 118.723 2.86 . . . . 0.0 118.723 -160.223 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -76.77 -94.97 0.02 OUTLIER 'General case' 0 CA--C 1.566 1.574 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -163.725 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 19.6 m -129.84 76.08 1.7 Allowed 'General case' 0 C--N 1.314 -0.977 0 O-C-N 120.794 -1.191 . . . . 0.0 109.303 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -130.79 45.87 2.75 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 117.397 2.369 . . . . 0.0 117.397 -170.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -84.85 -33.65 22.8 Favored 'General case' 0 CA--C 1.492 -1.278 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 170.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 503' ' ' HIS . . . . . 0.561 ' CD2' HD11 ' A' ' 535' ' ' LEU . 45.4 m170 -59.25 -51.68 68.94 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 504' ' ' PHE . . . . . 0.444 ' CZ ' ' HB3' ' A' ' 473' ' ' GLU . 97.0 m-85 -68.01 -25.76 65.55 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 113.973 -1.467 . . . . 0.0 114.308 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -63.83 -46.83 83.32 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 175.522 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.583 ' O ' HG23 ' A' ' 510' ' ' VAL . 2.6 t80 -64.37 -32.56 74.23 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.893 -1.049 . . . . 0.0 112.379 174.892 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.53 -50.4 72.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 173.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -51.98 -43.01 63.38 Favored 'General case' 0 C--N 1.355 0.845 0 CA-C-O 120.899 0.38 . . . . 0.0 110.126 173.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -55.98 -60.11 3.95 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.341 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 506' ' ' TYR . 21.5 t -58.07 -53.58 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 O-C-N 123.57 0.544 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.58 -36.94 85.25 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -174.007 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -70.06 -32.2 70.18 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.485 -0.486 . . . . 0.0 109.808 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -72.43 -27.69 62.49 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 178.22 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -67.04 -54.24 23.49 Favored 'General case' 0 CA--C 1.49 -1.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.907 171.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 515' ' ' TYR . . . . . 0.436 ' HA ' ' HB3' ' A' ' 519' ' ' ASP . 0.4 OUTLIER -49.96 -29.68 8.95 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.801 0.84 . . . . 0.0 112.552 178.333 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -63.77 -36.23 83.21 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.572 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -111.89 -59.41 1.99 Allowed 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.4 -176.116 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -157.31 118.81 3.69 Favored 'General case' 0 CA--C 1.493 -1.224 0 C-N-CA 125.148 1.379 . . . . 0.0 107.659 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 519' ' ' ASP . . . . . 0.436 ' HB3' ' HA ' ' A' ' 515' ' ' TYR . 2.2 p-10 -90.95 92.51 8.79 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -175.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -144.4 128.93 18.05 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 126.49 1.916 . . . . 0.0 107.055 162.453 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -70.32 132.42 45.65 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 119.546 1.066 . . . . 0.0 110.453 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -118.73 135.0 54.73 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 34.5 pt -79.47 -16.21 13.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 122.152 0.977 . . . . 0.0 110.216 -175.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.402 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 5.6 p -60.05 -30.9 69.5 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.258 172.318 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.73 -39.64 91.34 Favored 'General case' 0 CA--C 1.481 -1.675 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.771 178.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.3 99.59 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.325 -0.95 . . . . 0.0 109.34 175.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.432 ' O ' HG12 ' A' ' 530' ' ' VAL . 61.5 t -61.8 -35.92 70.65 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.375 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.966 175.416 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 528' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.5 mm100 -72.24 -24.24 61.34 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 121.498 -0.751 . . . . 0.0 111.332 176.517 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.409 ' CE2' HG22 ' A' ' 510' ' ' VAL . 9.2 m-85 -79.64 -23.08 42.82 Favored 'General case' 0 N--CA 1.44 -0.97 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 175.788 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.432 HG12 ' O ' ' A' ' 527' ' ' VAL 0.369 12.2 p -75.93 55.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.241 0.606 0 CA-C-O 123.062 1.41 . . . . 0.0 114.034 -177.99 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -105.0 -29.95 10.1 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 104.209 -2.515 . . . . 0.0 104.209 172.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 46.5 m -92.92 161.9 14.29 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 164.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -86.29 -58.43 2.63 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 -176.143 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.17 -79.64 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 -161.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.561 HD11 ' CD2' ' A' ' 503' ' ' HIS . 2.6 mm? -75.44 -17.27 60.2 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 122.109 0.956 . . . . 0.0 112.132 -172.252 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -77.84 -46.0 22.72 Favored 'General case' 0 C--N 1.272 -2.799 0 CA-C-N 113.775 -1.557 . . . . 0.0 107.523 -173.604 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -66.5 -38.32 86.98 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.086 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 32.1 m -57.07 -51.61 68.6 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.709 178.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 27.9 tp -57.7 -45.55 85.52 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 111.323 0.12 . . . . 0.0 111.323 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 78.9 mt -60.18 -37.79 74.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-O 121.424 0.631 . . . . 0.0 110.289 176.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.7 m -57.27 -35.41 69.73 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.474 176.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.31 -43.89 69.41 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.903 0.382 . . . . 0.0 110.218 174.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -60.9 -36.43 79.23 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.09 0.956 . . . . 0.0 113.084 -177.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -72.48 23.81 0.06 Allowed 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 545' ' ' TYR . . . . . 0.437 ' CD2' ' HE3' ' A' ' 478' ' ' LYS . 50.7 t80 -65.92 147.16 53.8 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.137 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -87.59 173.67 8.91 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -173.199 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.412 ' C ' ' H ' ' A' ' 549' ' ' ASP . 7.7 mp -80.53 21.42 0.64 Allowed 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -174.234 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 23.2 p-10 -77.02 22.78 0.19 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.197 0.599 . . . . 0.0 111.98 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 549' ' ' ASP . . . . . 0.412 ' H ' ' C ' ' A' ' 547' ' ' LEU . 23.0 m-20 -63.67 3.84 0.32 Allowed 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 127.148 2.179 . . . . 0.0 115.181 -175.365 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.475 ' HB3' ' HD2' ' A' ' 551' ' ' PRO . 47.0 mt-10 -60.26 151.57 67.19 Favored Pre-proline 0 C--N 1.308 -1.199 0 CA-C-O 118.789 -0.624 . . . . 0.0 109.74 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 551' ' ' PRO . . . . . 0.475 ' HD2' ' HB3' ' A' ' 550' ' ' GLU . 1.9 Cg_exo 8.99 74.71 0.0 OUTLIER 'Trans proline' 0 C--N 1.379 2.179 1 C-N-CA 126.534 4.823 . . . . 0.0 117.032 -164.339 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 56.0 p90 -84.56 5.0 29.46 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.574 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -73.5 10.4 1.06 Allowed 'General case' 0 C--N 1.288 -2.102 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -176.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -76.04 -21.66 56.56 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 168.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -25.41 -75.38 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 127.322 2.249 . . . . 0.0 113.348 178.643 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 22.4 pt -61.99 -35.73 70.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 C-N-CA 123.85 0.86 . . . . 0.0 112.432 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.34 -54.11 47.96 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -63.43 -46.34 86.76 Favored 'General case' 0 C--O 1.201 -1.496 0 CA-C-N 113.897 -1.501 . . . . 0.0 110.909 -179.448 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 559' ' ' TYR . . . . . 0.597 ' O ' HG12 ' A' ' 563' ' ' ILE . 75.5 t80 -57.77 -53.3 59.72 Favored 'General case' 0 C--N 1.291 -1.94 0 C-N-CA 123.798 0.839 . . . . 0.0 112.009 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 71.6 t -63.55 -46.63 94.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.445 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 64.4 m-20 -60.32 -47.7 84.9 Favored 'General case' 0 C--O 1.175 -2.842 0 CA-C-O 118.151 -0.928 . . . . 0.0 112.149 177.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 562' ' ' VAL . . . . . 0.49 ' HA ' ' HG2' ' A' ' 565' ' ' GLU . 55.6 t -60.38 -47.87 90.66 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.991 0 CA-C-N 119.271 0.941 . . . . 0.0 111.289 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.597 HG12 ' O ' ' A' ' 559' ' ' TYR . 38.5 mm -66.03 -32.41 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-O 121.543 0.687 . . . . 0.0 110.321 -176.334 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -92.29 -22.76 19.56 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -175.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.49 ' HG2' ' HA ' ' A' ' 562' ' ' VAL . 6.9 pt-20 -85.24 -28.69 25.2 Favored 'General case' 0 CA--C 1.505 -0.76 0 C-N-CA 119.473 -0.891 . . . . 0.0 109.039 -175.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 566' ' ' LYS . . . . . 0.474 ' HA ' ' HE3' ' A' ' 566' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.829 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.942 -175.78 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 73.9 mt . . . . . 0 N--CA 1.427 -1.614 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 49.6 m -98.67 105.63 17.8 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -167.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -68.09 -40.13 82.72 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 114.504 -1.225 . . . . 0.0 107.95 171.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -59.0 -32.14 69.42 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 113.517 -1.674 . . . . 0.0 110.856 -178.677 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.607 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 38.0 tt0 -67.16 -34.97 78.69 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.211 178.456 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.494 ' O ' ' HD3' ' A' ' 471' ' ' LYS . 2.2 tmtp? -66.66 -41.6 87.95 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -178.012 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 472' ' ' ALA . . . . . 0.437 ' HB3' HD11 ' A' ' 563' ' ' ILE . . . -60.06 -41.29 92.05 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.987 177.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 473' ' ' GLU . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 504' ' ' PHE . 0.3 OUTLIER -66.21 -39.41 89.61 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.386 179.629 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.607 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 98.2 mtt180 -55.08 -45.08 75.37 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.152 0.501 . . . . 0.0 109.83 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -68.14 -42.55 79.94 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.03 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -63.02 -52.81 61.45 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.799 -177.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.79 -40.42 92.53 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 124.007 0.817 . . . . 0.0 109.865 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 19.5 tttp -49.17 -70.69 0.08 Allowed 'General case' 0 C--O 1.221 -0.425 0 O-C-N 123.888 0.742 . . . . 0.0 111.994 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . 0.26 16.6 m170 27.97 -100.92 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 115.324 1.602 . . . . 0.0 115.324 -174.268 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 78.9 mt -166.46 179.95 5.27 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 126.084 1.754 . . . . 0.0 106.762 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 1.4 pmm? -75.93 -8.41 56.85 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.783 0.802 . . . . 0.0 110.293 178.091 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -63.08 -47.24 83.73 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 124.76 1.224 . . . . 0.0 110.392 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 483' ' ' ASP . . . . . 0.523 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 3.3 m-20 -71.34 43.71 0.08 Allowed 'General case' 0 C--N 1.285 -2.203 0 C-N-CA 126.647 1.979 . . . . 0.0 115.78 -172.567 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -67.57 -39.77 84.91 Favored 'General case' 0 C--O 1.247 0.929 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.21 -52.53 65.17 Favored 'General case' 0 C--O 1.205 -1.282 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.242 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.523 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 3.4 m -56.92 -42.73 80.51 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 124.661 1.184 . . . . 0.0 111.22 -177.38 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 487' ' ' PHE . . . . . 0.463 ' CE1' ' HE2' ' A' ' 491' ' ' TYR . 84.0 t80 -51.3 -56.61 12.11 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.637 0.775 . . . . 0.0 109.719 175.483 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 63.7 mt -74.81 -28.3 60.66 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 122.085 -0.384 . . . . 0.0 111.341 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -69.81 -27.12 64.62 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.288 0.566 . . . . 0.0 110.859 -177.839 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.22 -40.31 19.79 Favored 'General case' 0 N--CA 1.414 -2.233 0 C-N-CA 120.084 -0.646 . . . . 0.0 109.318 177.28 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 491' ' ' TYR . . . . . 0.463 ' HE2' ' CE1' ' A' ' 487' ' ' PHE . 42.1 m-85 -58.01 -32.64 68.13 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.577 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -77.71 -38.85 46.41 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.607 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 17.8 t -87.23 -39.28 15.58 Favored 'General case' 0 C--O 1.249 1.074 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -173.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 41.9 t -92.97 166.66 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 -175.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -80.27 117.39 21.0 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -67.96 -44.37 76.87 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.078 -176.399 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.07 -53.86 47.03 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 -169.236 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -76.69 -35.0 58.17 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.176 -174.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 499' ' ' PHE . . . . . 0.442 ' CZ ' HG23 ' A' ' 563' ' ' ILE 0.262 37.2 m-85 -78.6 -15.25 58.75 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -178.357 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 57.4 m -77.04 86.91 3.54 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 118.737 -1.185 . . . . 0.0 108.379 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -84.45 -178.2 6.84 Favored 'General case' 0 C--O 1.208 -1.112 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -63.15 -35.38 80.1 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.309 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -59.31 -56.92 15.9 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.565 -1.652 . . . . 0.0 108.422 177.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 504' ' ' PHE . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 473' ' ' GLU 0.309 57.6 m-85 -66.73 -26.83 67.19 Favored 'General case' 0 N--CA 1.421 -1.88 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 178.865 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 36.1 tttm -63.0 -47.6 82.41 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 175.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.567 ' O ' HG23 ' A' ' 510' ' ' VAL . 9.2 m-85 -52.51 -60.7 2.92 Favored 'General case' 0 N--CA 1.439 -1.022 0 O-C-N 124.506 1.129 . . . . 0.0 110.937 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 507' ' ' VAL . . . . . 0.47 HG22 ' HA ' ' A' ' 504' ' ' PHE . 22.7 m -65.45 -44.81 94.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -50.49 -51.83 43.7 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.094 0.557 . . . . 0.0 110.604 176.164 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -57.74 -51.93 67.52 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.541 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 506' ' ' TYR . 21.8 t -62.42 -47.6 92.26 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 O-C-N 123.475 0.484 . . . . 0.0 111.764 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 3.8 tt -68.2 -41.33 81.53 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.859 -174.468 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -66.53 -41.98 87.94 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.376 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -64.23 -49.33 72.36 Favored 'General case' 0 CA--C 1.501 -0.907 0 C-N-CA 123.272 0.629 . . . . 0.0 110.763 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -61.63 -46.96 87.54 Favored 'General case' 0 C--O 1.177 -2.738 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.946 177.073 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 515' ' ' TYR . . . . . 0.468 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 0.5 OUTLIER -48.29 -39.94 23.32 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.761 0.824 . . . . 0.0 110.0 -179.323 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.15 -56.52 5.92 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.467 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -95.48 -11.06 28.14 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -169.046 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -150.96 -151.29 0.38 Allowed 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 106.449 -1.686 . . . . 0.0 106.449 -175.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -97.38 -162.95 1.0 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 176.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -83.77 -170.69 3.2 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 118.431 0.56 . . . . 0.0 112.299 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -41.69 118.78 1.15 Allowed 'General case' 0 N--CA 1.418 -2.069 0 N-CA-C 115.559 1.689 . . . . 0.0 115.559 -178.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -107.27 111.55 23.98 Favored 'General case' 0 N--CA 1.415 -2.194 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 172.704 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 30.7 pt -54.78 -28.04 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.098 1.359 . . . . 0.0 112.901 -174.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 10.2 m -58.51 -31.52 67.96 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.563 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -36.65 77.91 Favored 'General case' 0 C--O 1.245 0.852 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.634 ' HA ' ' CD2' ' A' ' 529' ' ' TYR . . . -61.52 -35.6 78.18 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.04 178.336 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 52.3 t -67.91 -34.86 69.71 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.496 0 C-N-CA 124.381 1.072 . . . . 0.0 108.996 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -66.44 -20.74 66.13 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.051 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.634 ' CD2' ' HA ' ' A' ' 526' ' ' ALA . 18.9 m-85 -74.65 7.14 3.22 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.172 173.33 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.467 ' HA ' ' CB ' ' A' ' 536' ' ' ARG . 8.1 p -72.9 14.25 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.625 0 CA-C-O 122.334 1.064 . . . . 0.0 110.411 173.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 531' ' ' ASN . . . . . 0.437 ' H ' ' C ' ' A' ' 529' ' ' TYR . 46.3 m-80 -101.35 -21.18 14.91 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.584 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 532' ' ' SER . . . . . 0.549 ' OG ' ' HB2' ' A' ' 535' ' ' LEU . 80.9 p -83.91 157.89 21.79 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -63.5 -61.92 2.01 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -94.23 -40.5 9.97 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -173.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.549 ' HB2' ' OG ' ' A' ' 532' ' ' SER . 99.5 mt -62.99 -22.66 67.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -174.79 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.467 ' CB ' ' HA ' ' A' ' 530' ' ' VAL . 18.0 ptp180 -59.61 -42.84 93.54 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.428 0.632 . . . . 0.0 109.567 177.179 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -70.53 -56.53 6.33 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.274 -177.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.442 ' O ' HD13 ' A' ' 542' ' ' LEU . 12.9 m -59.12 -53.65 55.92 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.375 -176.486 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 539' ' ' LEU . . . . . 0.511 ' HB3' ' HB1' ' A' ' 526' ' ' ALA 0.262 4.4 mm? -61.72 -38.91 89.63 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.232 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 540' ' ' ILE . . . . . 0.578 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 69.4 mt -69.04 -36.77 75.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.052 176.665 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 57.5 m -56.17 -43.52 78.46 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.524 0.678 . . . . 0.0 109.617 173.149 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.442 HD13 ' O ' ' A' ' 538' ' ' THR . 8.8 mp -65.63 -31.23 72.15 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.114 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -70.9 -41.42 71.3 Favored 'General case' 0 C--N 1.317 -0.844 0 O-C-N 122.086 -0.384 . . . . 0.0 110.772 177.403 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 544' ' ' GLN . . . . . 0.578 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 76.5 mt-30 -69.9 -27.87 65.15 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.195 -177.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -67.48 118.59 11.02 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 174.351 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -124.7 130.67 52.85 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -168.165 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 61.9 tp -75.24 -27.89 59.66 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.956 -178.15 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -73.17 -36.81 66.67 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.806 -0.357 . . . . 0.0 111.058 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -68.73 -55.25 11.96 Favored 'General case' 0 CA--C 1.508 -0.673 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.382 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.53 114.5 25.26 Favored Pre-proline 0 C--N 1.298 -1.654 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.74 151.74 74.49 Favored 'Trans proline' 0 C--O 1.249 1.041 0 C-N-CA 122.585 2.19 . . . . 0.0 111.333 175.969 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -126.89 49.86 2.02 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.824 0.821 . . . . 0.0 111.307 -174.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.96 -12.63 60.0 Favored 'General case' 0 C--N 1.285 -2.23 0 CA-C-O 121.667 0.746 . . . . 0.0 112.314 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -79.29 -22.29 44.84 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 124.489 1.116 . . . . 0.0 108.789 173.477 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -39.07 -69.36 0.13 Allowed 'General case' 0 C--O 1.199 -1.56 0 C-N-CA 125.331 1.453 . . . . 0.0 111.585 -175.655 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 38.8 pt -54.1 -39.68 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 123.724 0.64 . . . . 0.0 112.193 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.35 -55.01 36.47 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.951 0.9 . . . . 0.0 110.995 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -73.96 -35.89 64.56 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.326 -175.58 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 559' ' ' TYR . . . . . 0.647 ' CE1' HD12 ' A' ' 563' ' ' ILE . 93.4 t80 -57.25 -52.74 64.11 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 125.164 1.386 . . . . 0.0 111.648 177.977 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 14.4 p -64.21 -38.37 82.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 109.811 -0.441 . . . . 0.0 109.811 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.483 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 27.1 t-20 -61.76 -45.41 94.02 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.476 178.422 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.54 -50.47 34.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -178.27 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.647 HD12 ' CE1' ' A' ' 559' ' ' TYR . 30.5 mt -95.85 -45.74 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.118 0 CA-C-O 121.793 0.806 . . . . 0.0 111.638 -167.897 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -81.24 6.75 13.11 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 122.485 1.136 . . . . 0.0 108.076 -175.11 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 4.2 tm-20 -57.91 -39.12 77.16 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 169.309 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm . . . . . 0 C--N 1.32 -0.703 0 CA-C-N 113.955 -1.475 . . . . 0.0 113.145 -178.962 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 466' ' ' LEU . . . . . 0.533 HD12 ' O ' ' A' ' 466' ' ' LEU . 3.2 pp . . . . . 0 N--CA 1.417 -2.091 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 467' ' ' SER . . . . . 0.52 ' HB2' ' OE1' ' A' ' 469' ' ' GLN . 4.0 p -109.64 162.86 14.02 Favored 'General case' 0 C--N 1.279 -2.496 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -176.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 468' ' ' ARG . . . . . 0.549 ' O ' ' HB2' ' A' ' 471' ' ' LYS . 4.3 ptp180 -64.93 -18.08 64.92 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.252 0.548 . . . . 0.0 112.076 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.52 ' OE1' ' HB2' ' A' ' 467' ' ' SER . 26.3 mp0 -65.15 -27.23 68.57 Favored 'General case' 0 C--N 1.31 -1.122 0 O-C-N 122.072 -0.393 . . . . 0.0 111.922 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.442 ' HA ' ' OE1' ' A' ' 473' ' ' GLU . 2.3 mp0 -67.02 -25.46 66.3 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 120.983 0.421 . . . . 0.0 111.274 173.289 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.549 ' HB2' ' O ' ' A' ' 468' ' ' ARG . 16.6 mmtp -67.94 -41.1 83.07 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 173.397 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -65.23 -46.24 81.45 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.368 178.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 473' ' ' GLU . . . . . 0.579 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 50.1 mt-10 -54.28 -58.46 7.3 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 175.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 41.3 ttt-85 -51.37 -35.26 37.75 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 475' ' ' ALA . . . . . 0.624 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -62.27 -51.85 66.08 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -63.51 -44.34 94.59 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.71 0.767 . . . . 0.0 112.056 176.17 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 61.2 mt -73.4 -9.02 58.26 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 -173.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.624 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 24.7 pttm -74.38 -0.6 17.79 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.596 -0.69 . . . . 0.0 112.164 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.411 ' HB2' ' OD1' ' A' ' 483' ' ' ASP . 6.2 p80 -142.75 108.76 5.19 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 124.118 0.967 . . . . 0.0 108.81 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.519 HD13 HD21 ' A' ' 511' ' ' LEU . 93.0 mt -138.04 8.03 2.71 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -172.904 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 82.9 mtp -94.49 -66.16 0.93 Allowed 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 119.714 -0.795 . . . . 0.0 111.743 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -71.9 -29.15 64.03 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 122.685 1.231 . . . . 0.0 109.862 177.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 483' ' ' ASP . . . . . 0.537 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 9.3 m-20 -71.11 51.52 0.16 Allowed 'General case' 0 C--N 1.288 -2.091 0 C-N-CA 127.834 2.453 . . . . 0.0 115.424 -172.624 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -66.19 -39.61 89.83 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -55.26 -46.05 76.12 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-N 114.045 -1.434 . . . . 0.0 109.538 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.537 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 23.5 m -65.53 -40.98 93.55 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 123.494 0.718 . . . . 0.0 111.774 -177.506 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 487' ' ' PHE . . . . . 0.406 ' CE2' ' HE1' ' A' ' 491' ' ' TYR . 37.8 t80 -60.49 -47.65 85.23 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.353 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.474 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 4.2 mm? -69.05 -31.57 70.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.904 178.225 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -72.11 -23.82 61.39 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.268 0.556 . . . . 0.0 110.145 177.317 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -83.48 -23.69 32.09 Favored 'General case' 0 N--CA 1.388 -3.555 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 491' ' ' TYR . . . . . 0.474 ' HB2' ' O ' ' A' ' 488' ' ' LEU . 28.9 m-85 -62.2 -42.38 99.24 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 167.625 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -70.84 -44.18 67.0 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.21 -0.905 . . . . 0.0 111.556 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 19.8 m -78.33 -8.87 58.92 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -174.712 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 87.4 t -122.17 107.83 20.58 Favored 'Isoleucine or valine' 0 C--O 1.249 1.04 0 CA-C-O 121.14 0.495 . . . . 0.0 110.753 -177.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . 0.272 6.9 p30 -150.67 -84.04 0.09 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 178.687 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.447 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 4.0 mptp? -76.73 -13.91 59.99 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.801 0.81 . . . . 0.0 112.059 -177.424 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -72.46 23.91 0.05 Allowed 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 125.977 1.711 . . . . 0.0 111.533 173.415 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 498' ' ' ASN . . . . . 0.427 ' H ' ' C ' ' A' ' 496' ' ' LYS . 4.2 p-10 -77.72 18.08 0.49 Allowed 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 123.722 0.809 . . . . 0.0 112.092 -176.079 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 499' ' ' PHE . . . . . 0.418 ' CE1' ' HD3' ' A' ' 566' ' ' LYS . 23.4 p90 -77.79 -22.56 49.94 Favored 'General case' 0 C--O 1.244 0.809 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 175.251 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 500' ' ' THR . . . . . 0.525 ' HB ' ' CE2' ' A' ' 504' ' ' PHE . 3.9 m -67.48 156.57 36.31 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.088 -1.414 . . . . 0.0 109.56 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.517 ' C ' ' H ' ' A' ' 503' ' ' HIS . 28.4 t-20 -65.72 164.36 14.7 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 124.496 1.118 . . . . 0.0 111.866 -175.372 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 502' ' ' GLN . . . . . 0.519 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 7.8 pt20 -58.6 14.32 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 127.201 2.2 . . . . 0.0 113.85 177.731 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 503' ' ' HIS . . . . . 0.517 ' H ' ' C ' ' A' ' 501' ' ' ASN . 7.8 t-160 -64.3 -55.47 21.13 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -174.323 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 504' ' ' PHE . . . . . 0.525 ' CE2' ' HB ' ' A' ' 500' ' ' THR . 0.1 OUTLIER -61.18 -24.18 66.12 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.141 -1.39 . . . . 0.0 114.069 174.824 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.519 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 45.3 tttp -62.14 -52.07 65.31 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.499 ' O ' HG23 ' A' ' 510' ' ' VAL 0.319 2.8 m-85 -69.12 -29.68 67.79 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 178.524 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 507' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 503' ' ' HIS . 82.2 t -63.25 -53.7 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.793 175.353 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -50.09 -53.88 24.23 Favored 'General case' 0 C--O 1.2 -1.536 0 O-C-N 123.166 0.291 . . . . 0.0 111.22 175.22 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -57.63 -60.05 4.26 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.941 1.46 . . . . 0.0 114.941 -176.737 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 506' ' ' TYR . 10.9 t -61.81 -43.38 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.478 -176.381 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.519 HD21 HD13 ' A' ' 480' ' ' LEU . 10.4 mp -66.64 -49.13 67.24 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.753 -177.623 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -61.74 -46.92 87.54 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 123.358 0.663 . . . . 0.0 110.047 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -55.88 -48.67 75.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.951 0.5 . . . . 0.0 111.722 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -70.82 -45.14 65.12 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.94 -178.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -52.59 -39.59 61.75 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 124.772 1.229 . . . . 0.0 109.434 175.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -64.63 -21.37 66.7 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.046 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -106.55 -56.46 2.19 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 121.056 0.455 . . . . 0.0 111.141 -178.84 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -117.58 -154.41 0.56 Allowed 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -173.158 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 519' ' ' ASP . . . . . 0.422 ' CG ' ' H ' ' A' ' 520' ' ' GLN . 16.9 t70 -87.22 -159.82 0.54 Allowed 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 125.849 1.659 . . . . 0.0 107.984 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 520' ' ' GLN . . . . . 0.422 ' H ' ' CG ' ' A' ' 519' ' ' ASP . 77.4 mm-40 -79.22 155.28 28.67 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -170.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -41.88 134.2 2.67 Favored 'General case' 0 N--CA 1.407 -2.597 0 C-N-CA 128.025 2.53 . . . . 0.0 116.255 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -118.1 158.49 24.93 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 106.308 -1.738 . . . . 0.0 106.308 173.196 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 45.3 pt -68.48 -23.37 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-O 121.583 0.706 . . . . 0.0 109.417 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.442 ' HA ' HG12 ' A' ' 527' ' ' VAL . 3.0 m -56.35 -40.06 73.87 Favored 'General case' 0 N--CA 1.417 -2.109 0 C-N-CA 125.166 1.386 . . . . 0.0 110.891 177.566 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 525' ' ' ASP . . . . . 0.425 ' O ' ' HB3' ' A' ' 528' ' ' GLN . 15.9 m-20 -68.4 -33.88 75.02 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.328 0.585 . . . . 0.0 110.4 179.347 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -64.18 -47.89 78.07 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.642 177.235 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.442 HG12 ' HA ' ' A' ' 524' ' ' SER . 7.6 p -70.86 -18.22 20.72 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.106 0 CA-C-O 121.77 0.795 . . . . 0.0 110.374 176.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 528' ' ' GLN . . . . . 0.425 ' HB3' ' O ' ' A' ' 525' ' ' ASP . 0.7 OUTLIER -68.17 -31.58 71.23 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 172.58 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.63 ' HB3' ' HG3' ' A' ' 536' ' ' ARG . 0.5 OUTLIER -85.21 11.38 10.07 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.764 175.223 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.56 ' HA ' ' CZ ' ' A' ' 536' ' ' ARG . 2.9 p -72.94 4.98 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -171.572 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -109.0 -35.99 6.2 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 119.948 -1.72 . . . . 0.0 110.749 176.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 532' ' ' SER . . . . . 0.589 ' O ' ' HG3' ' A' ' 534' ' ' GLU . 24.5 t -80.44 -145.2 0.05 OUTLIER 'General case' 0 CA--C 1.583 2.221 0 CA-C-N 114.474 -1.239 . . . . 0.0 110.342 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 533' ' ' ASN . . . . . 0.465 ' O ' ' N ' ' A' ' 535' ' ' LEU 0.574 5.3 t-20 -25.34 39.02 0.0 OUTLIER 'General case' 0 CA--C 1.465 -2.325 1 C-N-CA 137.084 6.154 . . . . 0.0 121.61 179.905 . . . . . . . . 4 3 . 1 . 011 nuclear build core ' A' A ' 534' ' ' GLU . . . . . 0.746 ' HA ' ' HD3' ' A' ' 536' ' ' ARG . 45.9 mt-10 -28.97 6.41 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.813 0 C-N-CA 129.19 2.996 . . . . 0.0 117.384 -177.592 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.465 ' N ' ' O ' ' A' ' 533' ' ' ASN . 1.0 OUTLIER -72.06 -21.48 61.51 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 162.411 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.746 ' HD3' ' HA ' ' A' ' 534' ' ' GLU . 0.0 OUTLIER -69.59 -18.26 63.6 Favored 'General case' 0 C--N 1.383 2.052 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 172.222 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 537' ' ' GLU . . . . . 0.51 ' N ' ' HD3' ' A' ' 536' ' ' ARG . 6.1 tp10 -76.95 -41.26 43.96 Favored 'General case' 0 CA--C 1.47 -2.117 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 -178.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.459 ' O ' HD13 ' A' ' 542' ' ' LEU . 27.6 m -54.96 -47.64 74.26 Favored 'General case' 0 N--CA 1.442 -0.873 0 O-C-N 124.05 0.844 . . . . 0.0 108.849 172.352 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 59.5 tp -56.48 -48.18 77.68 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.267 177.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 540' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 536' ' ' ARG . 57.5 mt -63.72 -41.08 91.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-O 120.744 0.307 . . . . 0.0 110.729 178.603 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.2 m -56.99 -46.44 82.24 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.684 0.754 . . . . 0.0 109.993 174.331 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 538' ' ' THR . 6.0 mp -67.53 -16.15 64.04 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 124.43 1.092 . . . . 0.0 112.652 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -88.26 -39.85 14.11 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 177.099 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -67.09 -36.78 82.71 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -68.27 129.18 39.16 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 170.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -74.95 109.06 8.09 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 122.382 1.087 . . . . 0.0 112.189 -168.531 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 547' ' ' LEU . 1.0 OUTLIER -78.96 -13.93 59.51 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 113.3 -1.773 . . . . 0.0 113.505 -177.215 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -75.94 -6.98 53.48 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.114 0.483 . . . . 0.0 110.666 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -72.59 -8.33 54.67 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.888 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -87.69 149.02 45.25 Favored Pre-proline 0 C--N 1.312 -1.054 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 551' ' ' PRO . . . . . 0.42 ' O ' ' HB2' ' A' ' 554' ' ' ASN . 23.2 Cg_exo -66.84 129.43 20.87 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.035 1.823 . . . . 0.0 107.99 172.52 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 552' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 555' ' ' GLU . 21.6 t80 -82.84 -6.09 59.28 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 121.937 0.875 . . . . 0.0 111.23 -172.313 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -82.88 -8.63 59.56 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-O 121.773 0.797 . . . . 0.0 111.502 172.198 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 554' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 551' ' ' PRO . 6.6 m-20 -73.04 -22.89 60.55 Favored 'General case' 0 C--O 1.198 -1.622 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.357 177.076 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 555' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 552' ' ' TYR . 18.6 mm-40 -40.0 -83.65 0.01 OUTLIER 'General case' 0 C--O 1.196 -1.73 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -164.079 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 556' ' ' ILE . . . . . 0.473 ' H ' HD12 ' A' ' 556' ' ' ILE . 0.6 OUTLIER -67.59 -39.27 82.0 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-O 121.573 0.701 . . . . 0.0 110.037 -176.722 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.88 -59.81 4.85 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.341 -173.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -73.83 -39.25 64.17 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.147 -176.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 559' ' ' TYR . . . . . 0.516 ' O ' HG13 ' A' ' 563' ' ' ILE . 93.5 t80 -50.34 -53.34 29.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.257 1.023 . . . . 0.0 111.018 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.4 t -64.69 -40.35 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.768 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.446 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 2.4 t-20 -59.04 -45.92 89.52 Favored 'General case' 0 C--O 1.194 -1.833 0 CA-C-O 119.331 -0.366 . . . . 0.0 110.58 175.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 562' ' ' VAL . . . . . 0.499 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 91.2 t -66.17 -33.15 61.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.475 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 559' ' ' TYR . 14.4 mt -87.09 -31.74 6.12 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.983 0 C-N-CA 118.205 -1.398 . . . . 0.0 108.907 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -83.53 -2.25 55.56 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.638 176.477 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.499 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 11.4 tp10 -73.6 -11.17 60.34 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 113.761 -1.563 . . . . 0.0 107.462 175.21 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 566' ' ' LYS . . . . . 0.418 ' HD3' ' CE1' ' A' ' 499' ' ' PHE . 38.4 ttpt . . . . . 0 CA--C 1.533 0.318 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.047 172.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 89.8 mt . . . . . 0 N--CA 1.432 -1.329 0 CA-C-O 120.938 0.399 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 37.0 t -88.95 106.57 18.5 Favored 'General case' 0 N--CA 1.421 -1.906 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -66.96 -36.93 83.31 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.432 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -68.23 -45.11 74.17 Favored 'General case' 0 C--O 1.198 -1.644 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.743 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -66.26 -22.85 66.32 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -177.262 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.408 ' HD3' ' C ' ' A' ' 471' ' ' LYS . 10.1 tmtt? -76.9 -37.39 55.54 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 172.738 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 472' ' ' ALA . . . . . 0.578 ' HB3' HD11 ' A' ' 563' ' ' ILE . . . -64.22 -51.82 61.81 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.31 178.273 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 473' ' ' GLU . . . . . 0.569 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 2.2 mp0 -53.42 -43.1 67.71 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 118.079 0.4 . . . . 0.0 110.961 176.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 61.5 mtt85 -53.82 -41.95 67.91 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 120.853 0.359 . . . . 0.0 111.183 172.447 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 475' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' A' ' 478' ' ' LYS . . . -71.23 -28.56 64.28 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 122.965 0.506 . . . . 0.0 112.317 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -35.06 79.68 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.663 -0.648 . . . . 0.0 110.171 176.396 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 45.9 mt -64.05 -8.99 13.56 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 124.61 1.164 . . . . 0.0 112.178 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.477 ' HB3' ' O ' ' A' ' 475' ' ' ALA . 80.3 tttt -71.31 -3.96 23.44 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.656 1.582 . . . . 0.0 111.804 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.488 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 16.9 m170 -96.58 152.47 18.61 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 7.9 mp -122.34 -63.99 1.24 Allowed 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 64.0 mtt -95.21 -57.39 2.43 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -171.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -67.77 -12.7 61.11 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 483' ' ' ASP . . . . . 0.488 ' HB2' ' HB3' ' A' ' 479' ' ' HIS . 26.2 t70 -75.07 8.36 2.64 Favored 'General case' 0 C--O 1.184 -2.379 0 C-N-CA 124.572 1.149 . . . . 0.0 113.13 -175.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -46.72 -61.81 1.67 Allowed 'General case' 0 C--O 1.275 2.395 0 C-N-CA 124.113 0.965 . . . . 0.0 112.682 -174.192 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -62.84 -43.14 99.59 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.631 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 28.1 m -60.81 -41.79 96.37 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.468 -177.105 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 487' ' ' PHE . . . . . 0.517 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 39.0 t80 -59.7 -47.12 86.9 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 123.061 0.544 . . . . 0.0 109.843 175.368 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 70.9 mt -66.04 -34.55 78.34 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.463 0.649 . . . . 0.0 110.533 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -67.15 -49.11 65.94 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.711 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 490' ' ' TYR . . . . . 0.496 ' CZ ' ' HE1' ' A' ' 559' ' ' TYR . 1.3 m-85 -76.96 -8.64 57.74 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 491' ' ' TYR . . . . . 0.517 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.4 OUTLIER -74.55 -52.39 12.0 Favored 'General case' 0 C--N 1.286 -2.185 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.689 176.348 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.17 -27.86 38.9 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -174.486 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 19.7 p -81.67 -24.42 36.29 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -176.137 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 50.6 t -96.68 156.24 3.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.086 0.47 . . . . 0.0 110.445 -175.653 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -85.91 124.44 32.38 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -176.78 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.56 ' HA ' ' OG1' ' A' ' 500' ' ' THR . 62.3 pttt -88.75 -15.82 33.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.13 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -69.6 -70.93 0.25 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -175.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -106.9 -31.74 8.21 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.502 -174.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -72.66 -37.35 67.97 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.67 -175.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 500' ' ' THR . . . . . 0.56 ' OG1' ' HA ' ' A' ' 496' ' ' LYS . 76.1 m -71.66 102.45 2.78 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.887 0.851 . . . . 0.0 112.496 -179.348 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -77.13 163.16 26.85 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.32 -1.309 . . . . 0.0 107.773 174.418 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -53.97 -34.84 60.89 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.966 0.803 . . . . 0.0 110.566 179.146 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -57.15 -56.11 25.97 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.981 175.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -66.13 -30.53 71.04 Favored 'General case' 0 CA--C 1.556 1.195 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.736 -178.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -67.3 -47.71 69.77 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 124.12 0.968 . . . . 0.0 110.072 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.558 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -59.74 -45.91 90.75 Favored 'General case' 0 N--CA 1.425 -1.694 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.869 -178.996 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 11.8 p -68.28 -40.96 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 O-C-N 123.428 0.455 . . . . 0.0 111.049 -176.664 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -51.28 -53.92 31.0 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.079 0.466 . . . . 0.0 110.558 173.413 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.37 -41.85 98.95 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.992 -1.004 . . . . 0.0 113.521 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 506' ' ' TYR . 95.7 t -57.55 -52.45 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 CA-C-O 120.889 0.376 . . . . 0.0 110.814 176.769 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.5 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 10.2 mp -66.37 -38.69 88.13 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.949 -177.694 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -62.99 -49.2 75.61 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.629 0.58 . . . . 0.0 109.555 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -52.64 -51.29 60.73 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.677 0.791 . . . . 0.0 110.75 -179.075 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -64.11 -53.36 50.87 Favored 'General case' 0 C--O 1.187 -2.223 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.747 177.416 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 515' ' ' TYR . . . . . 0.5 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 3.6 t80 -52.0 -35.7 47.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.976 0.91 . . . . 0.0 110.968 -177.006 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.41 -25.26 62.26 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -117.28 -38.2 3.39 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.778 0.799 . . . . 0.0 111.951 -177.572 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -124.82 -153.09 0.54 Allowed 'General case' 0 C--N 1.285 -2.233 0 C-N-CA 124.802 1.241 . . . . 0.0 109.16 -171.618 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -85.2 -162.01 0.66 Allowed 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 520' ' ' GLN . . . . . 0.463 ' HG2' ' H ' ' A' ' 521' ' ' TYR . 8.3 tt0 -82.36 -169.74 2.58 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -177.474 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 521' ' ' TYR . . . . . 0.463 ' H ' ' HG2' ' A' ' 520' ' ' GLN . 13.0 t80 -45.43 130.78 8.52 Favored 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 125.48 1.512 . . . . 0.0 114.266 -174.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -118.14 134.41 55.03 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 178.213 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 1.7 tt -53.72 -26.26 13.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 125.441 1.496 . . . . 0.0 112.029 179.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 48.1 t -54.34 -38.61 66.23 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 122.749 0.42 . . . . 0.0 111.548 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 525' ' ' ASP . . . . . 0.53 ' O ' ' HB3' ' A' ' 528' ' ' GLN . 2.8 t70 -72.04 -36.91 69.77 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -58.13 -55.53 33.77 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.132 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.445 ' O ' HG12 ' A' ' 530' ' ' VAL . 14.7 p -66.98 -18.84 24.84 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 CA-C-O 121.498 0.666 . . . . 0.0 111.423 179.296 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 528' ' ' GLN . . . . . 0.53 ' HB3' ' O ' ' A' ' 525' ' ' ASP . 48.1 tt0 -65.8 -37.75 87.1 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 171.796 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.444 ' C ' ' H ' ' A' ' 531' ' ' ASN . 76.8 m-85 -79.8 9.48 5.16 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 176.982 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 527' ' ' VAL . 5.3 p -74.3 16.84 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 CA-C-O 122.413 1.102 . . . . 0.0 110.794 178.519 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 531' ' ' ASN . . . . . 0.444 ' H ' ' C ' ' A' ' 529' ' ' TYR . 91.2 m-20 -111.03 -29.57 7.84 Favored 'General case' 0 C--N 1.288 -2.079 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.021 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 12.9 m -81.2 158.52 24.86 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.696 -177.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 533' ' ' ASN . . . . . 0.48 ' O ' ' HG3' ' A' ' 537' ' ' GLU . 27.0 t-20 -65.97 -73.55 0.13 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -177.839 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -71.93 -32.33 67.23 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -172.07 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.409 ' H ' HD22 ' A' ' 535' ' ' LEU . 2.5 mm? -66.08 -38.53 88.52 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -178.314 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 11.6 ttm180 -64.4 -56.41 14.48 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 175.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 537' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 533' ' ' ASN . 42.4 mt-10 -55.83 -70.19 0.12 Allowed 'General case' 0 C--N 1.347 0.468 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.186 -177.771 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 8.9 m -64.31 -54.56 31.15 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -172.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 48.8 tp -63.99 -44.27 93.18 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.013 -173.069 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 540' ' ' ILE . . . . . 0.586 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 64.8 mt -69.27 -28.23 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.728 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 541' ' ' SER . . . . . 0.47 ' HB2' ' O ' ' A' ' 537' ' ' GLU . 9.0 t -57.43 -44.32 84.57 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 174.184 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.515 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 3.1 mm? -67.47 -23.53 65.51 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 176.183 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 543' ' ' GLU . . . . . 0.45 ' C ' ' H ' ' A' ' 545' ' ' TYR . 36.6 tt0 -76.63 -26.61 55.1 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 121.349 0.595 . . . . 0.0 109.773 174.628 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 544' ' ' GLN . . . . . 0.586 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 86.2 mt-30 -80.87 31.86 0.31 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 124.11 0.964 . . . . 0.0 110.368 177.268 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 545' ' ' TYR . . . . . 0.515 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 6.3 p90 -68.09 166.92 15.04 Favored 'General case' 0 N--CA 1.394 -3.27 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.792 -175.559 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -79.22 156.0 28.35 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 121.688 0.756 . . . . 0.0 112.304 -170.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' A' ' 549' ' ' ASP . 3.0 mm? -77.23 6.04 7.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.102 -177.863 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -79.39 21.9 0.46 Allowed 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 125.162 1.385 . . . . 0.0 110.072 177.055 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 549' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 547' ' ' LEU . 3.2 p-10 -67.36 0.5 2.85 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -172.506 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -61.96 140.65 95.73 Favored Pre-proline 0 C--N 1.324 -0.528 0 N-CA-C 104.905 -2.257 . . . . 0.0 104.905 170.913 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -0.64 66.34 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.094 1 C-N-CA 126.555 4.836 . . . . 0.0 115.532 -167.139 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -89.89 19.98 4.47 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 122.921 1.343 . . . . 0.0 109.76 -171.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 553' ' ' GLU . . . . . 0.418 ' H ' ' HG2' ' A' ' 553' ' ' GLU . 8.7 pt-20 -71.97 -4.6 29.44 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-N 113.577 -1.647 . . . . 0.0 110.854 177.411 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 554' ' ' ASN . . . . . 0.613 ' HA ' ' OD2' ' A' ' 557' ' ' ASP . 14.2 m120 -66.56 -23.07 66.16 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.29 172.234 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.01 -34.06 72.83 Favored 'General case' 0 C--O 1.21 -1.002 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 175.19 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 57.0 mt -76.45 -39.92 34.07 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.052 0 C-N-CA 124.123 0.969 . . . . 0.0 109.015 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 557' ' ' ASP . . . . . 0.613 ' OD2' ' HA ' ' A' ' 554' ' ' ASN . 20.1 m-20 -54.82 -54.15 46.02 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-O 121.759 0.79 . . . . 0.0 108.908 174.444 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.21 -50.66 70.62 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 113.538 -1.665 . . . . 0.0 109.564 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 559' ' ' TYR . . . . . 0.619 ' O ' HG12 ' A' ' 563' ' ' ILE . 52.5 t80 -56.14 -55.07 37.57 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 124.721 1.208 . . . . 0.0 111.304 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 75.6 t -64.97 -37.26 79.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.032 -174.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.4 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 4.1 t-20 -61.43 -41.04 96.55 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 176.125 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 562' ' ' VAL . . . . . 0.597 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 78.1 t -72.46 -40.47 63.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 C-N-CA 123.859 0.864 . . . . 0.0 113.175 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.619 HG12 ' O ' ' A' ' 559' ' ' TYR . 28.5 mm -89.02 -49.02 14.41 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.906 0 CA-C-O 122.03 0.919 . . . . 0.0 109.519 -170.031 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -77.49 3.5 13.32 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.559 -175.99 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 6.0 pt-20 -75.47 -23.18 56.82 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 174.742 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 87.8 tttt . . . . . 0 CA--C 1.548 0.876 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.421 178.236 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 466' ' ' LEU . . . . . 0.406 HD13 HH22 ' A' ' 474' ' ' ARG . 65.6 mt . . . . . 0 N--CA 1.433 -1.281 0 CA-C-O 120.8 0.333 . . . . 0.0 110.384 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 27.3 p -86.84 160.25 18.81 Favored 'General case' 0 C--N 1.292 -1.902 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.994 -177.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -64.11 -29.17 70.31 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.305 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -66.79 -44.43 81.33 Favored 'General case' 0 C--O 1.19 -2.029 0 O-C-N 123.293 0.37 . . . . 0.0 110.32 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.572 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 1.1 tm-20 -62.65 -28.67 70.08 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-O 121.348 0.594 . . . . 0.0 109.639 -178.038 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.566 ' O ' ' HD3' ' A' ' 471' ' ' LYS . 0.9 OUTLIER -71.2 -35.54 71.6 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 175.033 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -60.52 -48.94 79.56 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 473' ' ' GLU . . . . . 0.566 ' HB3' ' CD2' ' A' ' 504' ' ' PHE . 1.7 mp0 -58.54 -39.93 81.59 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 121.146 0.498 . . . . 0.0 110.722 175.911 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.572 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 93.8 mtt180 -62.23 -35.34 78.61 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.22 176.87 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -66.26 -38.12 87.1 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.651 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 476' ' ' PHE . . . . . 0.485 ' O ' HD12 ' A' ' 480' ' ' LEU . 1.3 m-85 -65.83 -26.73 67.8 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 174.285 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 95.1 mt -82.66 -17.08 45.83 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 175.324 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -40.95 -65.13 0.46 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -168.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.485 ' HA ' ' SD ' ' A' ' 481' ' ' MET . 5.7 t-80 -147.57 36.68 0.89 Allowed 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.131 -1.028 . . . . 0.0 108.869 -174.046 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.495 HD13 HG21 ' A' ' 486' ' ' THR . 84.0 mt -115.89 29.57 7.9 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.222 -174.467 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 481' ' ' MET . . . . . 0.485 ' SD ' ' HA ' ' A' ' 479' ' ' HIS . 2.1 mpp? -76.07 -38.31 57.2 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.759 -176.363 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -67.82 -48.2 66.89 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-O 121.912 0.863 . . . . 0.0 110.126 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . 0.432 9.0 p-10 -74.51 60.49 0.88 Allowed 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 484' ' ' LYS . . . . . 0.489 ' HB2' ' CE2' ' A' ' 515' ' ' TYR . 19.5 ptpt -40.83 -30.97 0.14 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.144 2.178 . . . . 0.0 112.858 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -52.17 -50.19 62.3 Favored 'General case' 0 CA--C 1.504 -0.804 0 C-N-CA 124.796 1.238 . . . . 0.0 108.94 176.292 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.495 HG21 HD13 ' A' ' 480' ' ' LEU . 31.6 m -64.28 -35.88 82.27 Favored 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 125.324 1.45 . . . . 0.0 111.968 -177.374 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -59.32 -53.13 61.7 Favored 'General case' 0 C--O 1.258 1.506 0 CA-C-O 121.76 0.79 . . . . 0.0 109.151 177.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.515 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 4.0 mm? -72.2 -25.06 61.52 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.908 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -65.26 -33.15 75.3 Favored 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 122.982 0.176 . . . . 0.0 110.604 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.79 -33.95 40.07 Favored 'General case' 0 N--CA 1.385 -3.679 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -66.47 -27.33 67.72 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 120.1 -0.64 . . . . 0.0 112.4 173.145 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 492' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 14.4 mm-40 -78.51 -28.28 46.25 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.083 0.468 . . . . 0.0 110.967 175.573 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 51.0 m -85.09 -49.54 8.18 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.601 0.715 . . . . 0.0 110.986 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.2 t -135.96 100.23 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.526 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.523 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 495' ' ' ASP . . . . . 0.426 ' C ' ' H ' ' A' ' 497' ' ' ASP . 6.0 p-10 -95.19 14.91 20.61 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 122.405 1.097 . . . . 0.0 109.171 174.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -84.64 21.76 1.45 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 127.073 2.149 . . . . 0.0 109.42 178.152 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 497' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 495' ' ' ASP . 9.7 t70 -53.16 -1.44 0.02 OUTLIER 'General case' 0 CA--C 1.563 1.46 0 C-N-CA 128.991 2.916 . . . . 0.0 114.709 -176.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -73.88 -0.99 17.69 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 120.686 -1.259 . . . . 0.0 112.033 -175.463 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -83.46 -18.84 37.2 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.897 177.446 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 500' ' ' THR . . . . . 0.459 ' HB ' ' HB3' ' A' ' 504' ' ' PHE . 23.4 p -60.87 158.23 13.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -172.152 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -91.8 167.31 12.25 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.533 175.202 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -59.84 -24.32 64.11 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 118.453 0.57 . . . . 0.0 110.054 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -54.79 -53.65 52.41 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 175.873 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 504' ' ' PHE . . . . . 0.566 ' CD2' ' HB3' ' A' ' 473' ' ' GLU . 10.6 t80 -64.4 -40.02 94.98 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.415 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -57.67 -47.2 82.97 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 123.943 0.777 . . . . 0.0 109.25 -176.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.616 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -60.77 -45.53 93.99 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.135 -179.176 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 45.9 t -62.8 -48.55 87.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 120.385 -0.526 . . . . 0.0 110.221 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -49.54 -49.78 44.68 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.951 0.782 . . . . 0.0 110.654 174.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -58.22 -55.84 29.74 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.946 -177.747 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 506' ' ' TYR . 12.1 t -57.69 -52.03 62.64 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.512 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 88.9 mt -56.31 -53.05 61.88 Favored 'General case' 0 C--O 1.213 -0.859 0 O-C-N 123.819 0.699 . . . . 0.0 111.421 -176.434 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -61.64 -38.49 87.87 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.519 0.728 . . . . 0.0 110.588 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -67.49 -52.27 41.22 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.451 -176.515 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . 0.264 5.0 p90 -73.71 -31.11 63.24 Favored 'General case' 0 C--O 1.192 -1.936 0 C-N-CA 119.008 -1.077 . . . . 0.0 111.985 -178.981 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 515' ' ' TYR . . . . . 0.512 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 0.4 OUTLIER -55.67 -41.54 73.8 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.811 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -67.18 -18.69 65.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.151 -0.932 . . . . 0.0 112.497 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -115.67 -44.8 2.93 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 119.948 -0.701 . . . . 0.0 112.168 -178.103 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 518' ' ' ASN . . . . . 0.427 ' HB3' ' H ' ' A' ' 519' ' ' ASP . 15.0 m120 -125.59 -151.79 0.49 Allowed 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 124.852 1.261 . . . . 0.0 111.391 -168.741 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 519' ' ' ASP . . . . . 0.427 ' H ' ' HB3' ' A' ' 518' ' ' ASN . 6.1 p-10 -105.51 -157.49 0.62 Allowed 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 127.047 2.139 . . . . 0.0 110.456 -173.738 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -60.51 177.68 0.27 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 125.834 1.654 . . . . 0.0 113.876 -170.914 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -90.29 146.92 23.84 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.87 1.668 . . . . 0.0 109.085 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -118.58 155.33 31.12 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 50.1 pt -64.0 -21.87 29.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 O-C-N 122.249 -0.282 . . . . 0.0 111.567 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 22.7 t -57.66 -34.87 69.82 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -63.71 -50.32 69.65 Favored 'General case' 0 C--N 1.349 0.549 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -59.0 -44.37 91.66 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.594 0.712 . . . . 0.0 110.857 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.502 ' O ' HG22 ' A' ' 530' ' ' VAL . 55.8 t -65.1 -37.46 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.531 0 C-N-CA 124.052 0.941 . . . . 0.0 111.912 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -70.21 -16.85 63.11 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 117.95 -1.5 . . . . 0.0 110.213 175.644 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -80.59 6.42 12.65 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 172.89 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.502 HG22 ' O ' ' A' ' 527' ' ' VAL . 26.9 m -74.34 10.63 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.514 173.559 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -99.12 -15.02 19.13 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.943 177.24 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 532' ' ' SER . . . . . 0.478 ' HB2' ' HB2' ' A' ' 535' ' ' LEU . 27.1 m -88.69 156.2 19.14 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.776 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -63.18 -75.01 0.08 Allowed 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -86.4 -28.55 23.51 Favored 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 121.399 0.619 . . . . 0.0 110.257 -173.188 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.478 ' HB2' ' HB2' ' A' ' 532' ' ' SER . 58.3 mt -62.08 -32.95 73.55 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.942 -174.56 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -53.84 -63.43 1.15 Allowed 'General case' 0 C--O 1.255 1.37 0 O-C-N 124.293 0.996 . . . . 0.0 109.675 176.224 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -63.26 -55.72 22.52 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.359 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.421 ' O ' HD13 ' A' ' 542' ' ' LEU . 23.4 m -58.83 -53.81 54.21 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -174.752 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 539' ' ' LEU . . . . . 0.422 HD13 ' HA ' ' A' ' 539' ' ' LEU 0.299 4.0 mm? -63.88 -40.4 96.45 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -176.493 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 58.6 mt -68.85 -34.91 66.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 118.637 -1.225 . . . . 0.0 109.774 176.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 34.6 t -56.76 -48.91 76.76 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.5 ' HA ' ' CE2' ' A' ' 545' ' ' TYR . 6.6 mp -64.7 -32.22 73.8 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 124.671 1.188 . . . . 0.0 112.454 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.59 -54.83 7.26 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.363 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 544' ' ' GLN . . . . . 0.551 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 46.9 tt0 -74.64 35.08 0.1 Allowed 'General case' 0 CA--C 1.564 1.489 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -173.931 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 545' ' ' TYR . . . . . 0.5 ' CE2' ' HA ' ' A' ' 542' ' ' LEU . 16.6 m-85 -77.28 166.35 23.29 Favored 'General case' 0 C--N 1.265 -3.105 0 O-C-N 120.491 -1.38 . . . . 0.0 110.882 170.498 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -93.5 117.85 30.59 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 92.8 mt -74.43 -16.27 60.88 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.199 -176.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -70.5 -43.07 70.44 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.838 177.391 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 549' ' ' ASP . . . . . 0.467 ' C ' ' HD3' ' A' ' 551' ' ' PRO . 40.6 m-20 -74.81 1.21 13.1 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.424 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.406 ' N ' ' HD3' ' A' ' 551' ' ' PRO . 35.6 tt0 -119.59 67.99 10.83 Favored Pre-proline 0 CA--C 1.567 1.623 0 C-N-CA 119.262 -0.975 . . . . 0.0 113.039 -175.071 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 551' ' ' PRO . . . . . 0.524 ' HD2' ' H ' ' A' ' 552' ' ' TYR . 72.1 Cg_endo -119.25 -14.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.579 2.747 0 C-N-CA 122.24 1.96 . . . . 0.0 114.658 168.44 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 552' ' ' TYR . . . . . 0.524 ' H ' ' HD2' ' A' ' 551' ' ' PRO . 48.7 m-85 -114.15 52.8 0.81 Allowed 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 124.773 1.229 . . . . 0.0 108.287 -171.206 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . 0.277 7.5 mm-40 -58.84 67.84 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 118.622 2.823 . . . . 0.0 118.622 -170.049 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 554' ' ' ASN . . . . . 0.4 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 9.6 m120 -65.94 -20.95 66.38 Favored 'General case' 0 C--O 1.194 -1.816 0 CA-C-N 113.649 -1.614 . . . . 0.0 108.992 169.22 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -43.91 -41.01 4.95 Favored 'General case' 0 C--O 1.204 -1.294 0 C-N-CA 124.611 1.164 . . . . 0.0 111.519 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 62.1 mt -64.17 -45.32 96.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 557' ' ' ASP . . . . . 0.4 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 13.7 t70 -60.03 -45.49 92.62 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.256 175.677 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 558' ' ' ASP . . . . . 0.504 ' O ' HG23 ' A' ' 562' ' ' VAL . 18.4 t70 -58.16 -56.34 23.34 Favored 'General case' 0 CA--C 1.503 -0.828 0 C-N-CA 124.404 1.082 . . . . 0.0 109.407 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -48.03 -53.16 17.21 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 125.28 1.432 . . . . 0.0 110.138 176.169 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 37.2 t -57.69 -50.94 75.84 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.949 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.772 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.04 -31.41 71.82 Favored 'General case' 0 C--O 1.209 -1.034 0 C-N-CA 123.3 0.64 . . . . 0.0 111.677 -179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 562' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 558' ' ' ASP . 78.0 t -69.0 -34.71 65.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 CA-C-O 121.329 0.585 . . . . 0.0 111.776 178.088 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 563' ' ' ILE . . . . . . . . . . . . . 57.3 mt -87.41 -35.67 8.72 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.248 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 59.7 t30 -77.62 2.57 16.22 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 113.694 -1.594 . . . . 0.0 109.83 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.32 -31.09 67.01 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 174.838 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp . . . . . 0 C--N 1.313 -0.991 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -174.442 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 96.5 mt . . . . . 0 N--CA 1.431 -1.388 0 CA-C-O 121.37 0.605 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 15.0 m -95.16 150.34 20.31 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.891 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 468' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' A' ' 471' ' ' LYS . 19.9 tpp180 -60.98 -20.38 62.32 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.621 1.169 . . . . 0.0 110.712 -178.771 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.778 HE21 ' HE2' ' A' ' 566' ' ' LYS . 0.9 OUTLIER -58.99 -40.57 85.25 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.642 177.971 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 34.2 tt0 -67.03 -30.81 71.0 Favored 'General case' 0 C--O 1.203 -1.345 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 468' ' ' ARG . 27.1 tptp -62.48 -37.93 87.88 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.904 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -64.44 -45.43 87.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.559 0.695 . . . . 0.0 109.239 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.94 -33.46 74.31 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.745 177.542 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.582 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 98.9 mtt180 -65.92 -36.8 84.37 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 122.459 0.304 . . . . 0.0 110.524 175.118 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -65.9 -45.5 81.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.307 0.575 . . . . 0.0 109.954 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.28 -27.78 68.71 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 122.031 0.919 . . . . 0.0 111.173 175.821 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.48 ' HB3' ' O ' ' A' ' 474' ' ' ARG . 61.8 tp -77.22 -14.83 59.7 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 126.004 1.722 . . . . 0.0 113.557 -175.314 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -41.12 -50.26 3.46 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.312 1.045 . . . . 0.0 110.833 -173.204 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -168.2 128.23 1.28 Allowed 'General case' 0 CA--C 1.48 -1.73 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 166.584 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.515 ' HG ' ' OD2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -58.48 119.49 7.09 Favored 'General case' 0 C--O 1.251 1.145 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 -179.599 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 72.8 mtm -93.21 -53.57 4.05 Favored 'General case' 0 N--CA 1.424 -1.759 0 N-CA-C 115.343 1.608 . . . . 0.0 115.343 -172.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 482' ' ' ARG . . . . . 0.641 ' HB2' ' OG1' ' A' ' 486' ' ' THR 0.255 36.4 mmt180 -76.33 -99.05 0.02 OUTLIER 'General case' 0 C--O 1.212 -0.875 0 C-N-CA 116.379 -2.129 . . . . 0.0 114.409 -174.263 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 483' ' ' ASP . . . . . 0.644 ' OD2' ' HG3' ' A' ' 484' ' ' LYS . 25.4 t70 -145.72 -86.89 0.11 Allowed 'General case' 0 C--O 1.196 -1.726 0 C-N-CA 115.639 -2.424 . . . . 0.0 116.819 170.157 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 484' ' ' LYS . . . . . 0.644 ' HG3' ' OD2' ' A' ' 483' ' ' ASP . 61.8 mttp -97.54 -52.33 3.82 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.669 -1.15 . . . . 0.0 113.464 -178.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -56.45 -42.75 78.69 Favored 'General case' 0 CA--C 1.497 -1.085 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.88 -178.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.641 ' OG1' ' HB2' ' A' ' 482' ' ' ARG . 42.2 m -61.51 -37.57 84.2 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.975 -177.705 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -62.62 -54.12 44.32 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.658 177.33 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 77.5 mt -66.8 -28.46 68.4 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.172 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -61.49 -40.97 96.5 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 123.765 0.826 . . . . 0.0 110.659 -179.18 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -92.51 -37.15 12.67 Favored 'General case' 0 N--CA 1.399 -3.02 0 C-N-CA 120.486 -0.485 . . . . 0.0 110.732 178.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -79.95 -59.65 2.64 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -175.23 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -78.82 -7.4 57.83 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.839 0.828 . . . . 0.0 111.751 -166.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 18.2 m -75.51 -6.8 52.04 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.469 177.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 46.0 t -100.27 99.22 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -97.45 -82.84 0.41 Allowed 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -83.17 -26.88 30.49 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.575 0.702 . . . . 0.0 110.876 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 497' ' ' ASP . . . . . 0.408 ' C ' ' H ' ' A' ' 499' ' ' PHE . 38.0 t70 -77.56 31.09 0.15 Allowed 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 125.574 1.55 . . . . 0.0 110.914 -178.259 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -72.93 33.53 0.07 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.688 1.195 . . . . 0.0 111.78 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 499' ' ' PHE . . . . . 0.408 ' H ' ' C ' ' A' ' 497' ' ' ASP . 15.1 p90 -73.52 -13.81 61.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.055 -179.719 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.84 150.78 31.78 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -74.72 163.81 27.28 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 114.801 -1.091 . . . . 0.0 112.052 -172.158 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 502' ' ' GLN . . . . . 0.47 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 59.9 tt0 -56.18 -5.22 0.17 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.438 1.895 . . . . 0.0 111.839 177.723 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -52.6 -45.17 66.43 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 172.047 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.84 -30.31 70.03 Favored 'General case' 0 C--O 1.204 -1.301 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.646 175.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 505' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 22.1 tptm -70.35 -47.75 59.54 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.241 0.617 . . . . 0.0 110.332 -175.415 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.517 ' O ' HG23 ' A' ' 510' ' ' VAL . 96.9 m-85 -59.63 -46.8 87.92 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 507' ' ' VAL . . . . . 0.413 ' CG2' HD11 ' A' ' 477' ' ' LEU . 71.1 t -58.25 -57.49 10.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 114.227 -1.351 . . . . 0.0 111.263 178.134 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -48.41 -45.59 36.32 Favored 'General case' 0 C--O 1.212 -0.885 0 O-C-N 124.047 0.842 . . . . 0.0 112.349 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.3 -53.77 52.46 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.048 0.452 . . . . 0.0 110.491 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 506' ' ' TYR . 24.5 t -60.85 -51.35 74.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 CA-C-O 121.368 0.604 . . . . 0.0 111.097 -178.63 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 10.4 mp -66.91 -34.05 76.92 Favored 'General case' 0 C--O 1.2 -1.546 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.482 -175.707 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -65.85 -29.53 70.0 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 120.99 0.424 . . . . 0.0 110.548 176.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.12 -37.05 80.7 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.359 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 514' ' ' PHE . . . . . 0.405 ' HB3' ' HA ' ' A' ' 519' ' ' ASP . 28.9 m-85 -76.46 -46.16 28.1 Favored 'General case' 0 C--O 1.2 -1.551 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.324 178.738 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -46.21 -32.83 3.24 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.901 1.68 . . . . 0.0 111.129 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -57.55 -29.8 64.69 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.783 178.27 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -119.77 -59.73 1.78 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.016 175.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -158.31 124.32 4.61 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 176.109 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 519' ' ' ASP . . . . . 0.515 ' OD2' ' HG ' ' A' ' 480' ' ' LEU . 24.3 t0 -95.4 96.75 9.32 Favored 'General case' 0 CA--C 1.484 -1.572 0 C-N-CA 117.274 -1.77 . . . . 0.0 110.468 179.616 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 520' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 482' ' ' ARG . 88.5 mt-30 -137.86 77.1 1.61 Allowed 'General case' 0 C--N 1.274 -2.7 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 178.196 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -46.53 121.05 3.21 Favored 'General case' 0 N--CA 1.427 -1.588 0 C-N-CA 126.093 1.757 . . . . 0.0 113.039 -174.551 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -91.02 167.13 12.61 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.602 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 44.7 pt -87.07 -17.37 8.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 C-N-CA 120.166 -0.614 . . . . 0.0 112.132 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 23.0 t -60.16 -46.17 90.6 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.19 -38.04 87.6 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.676 176.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -60.37 -48.03 83.53 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 120.998 0.428 . . . . 0.0 110.409 176.422 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.518 ' O ' HG22 ' A' ' 530' ' ' VAL . 97.5 t -64.98 -30.71 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 C-N-CA 123.719 0.807 . . . . 0.0 111.018 177.363 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -65.1 -32.55 74.31 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.416 -0.802 . . . . 0.0 109.159 172.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -77.71 10.78 2.47 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 176.265 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.518 HG22 ' O ' ' A' ' 527' ' ' VAL . 22.1 m -75.26 6.79 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 118.313 -1.355 . . . . 0.0 111.264 171.412 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -93.59 -8.06 42.28 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.079 175.748 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 20.1 m -85.66 154.76 21.45 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 176.009 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -71.71 -73.11 0.19 Allowed 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 178.535 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -81.22 -36.8 29.58 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.837 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 43.9 tp -65.16 -34.6 78.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.865 -177.092 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 38.2 ttp180 -57.89 -54.53 45.88 Favored 'General case' 0 C--O 1.254 1.315 0 CA-C-O 121.718 0.77 . . . . 0.0 109.344 176.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -53.42 -70.34 0.09 Allowed 'General case' 0 N--CA 1.425 -1.696 0 CA-C-N 113.369 -1.741 . . . . 0.0 110.669 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.441 ' O ' HD13 ' A' ' 542' ' ' LEU 0.291 6.4 p -64.4 -52.69 56.91 Favored 'General case' 0 N--CA 1.425 -1.688 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -173.18 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 51.8 tp -59.03 -44.43 91.74 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -174.685 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 1.8 mp -75.04 -38.87 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 119.551 -0.86 . . . . 0.0 109.43 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 30.1 t -55.41 -45.6 76.71 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.484 175.717 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 545' ' ' TYR . 5.2 mp -64.95 -37.53 87.96 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.063 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 543' ' ' GLU . . . . . 0.478 ' C ' ' H ' ' A' ' 545' ' ' TYR . 13.1 tp10 -64.99 -33.62 76.49 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.884 0.373 . . . . 0.0 110.886 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -76.43 40.9 0.23 Allowed 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 123.048 1.404 . . . . 0.0 110.67 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 545' ' ' TYR . . . . . 0.499 ' HB2' ' O ' ' A' ' 542' ' ' LEU . 2.8 t80 -72.09 -172.69 0.92 Allowed 'General case' 0 C--N 1.283 -2.294 0 C-N-CA 128.658 2.783 . . . . 0.0 110.658 -176.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 546' ' ' ASN . . . . . 0.474 ' HB2' ' OD1' ' A' ' 548' ' ' ASN . 1.6 m-80 -85.98 172.08 10.94 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -80.02 14.19 1.94 Allowed 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.158 0.504 . . . . 0.0 111.689 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 548' ' ' ASN . . . . . 0.474 ' OD1' ' HB2' ' A' ' 546' ' ' ASN . 3.6 p-10 -75.94 -2.03 28.39 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 123.901 0.88 . . . . 0.0 112.472 -176.625 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -69.75 33.34 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.362 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.416 ' HB3' ' CD ' ' A' ' 551' ' ' PRO . 46.2 mt-10 -103.15 -176.99 0.48 Allowed Pre-proline 0 C--N 1.305 -1.336 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 172.645 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 551' ' ' PRO . . . . . 0.416 ' CD ' ' HB3' ' A' ' 550' ' ' GLU . 33.7 Cg_exo -62.97 61.95 0.16 Allowed 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.433 2.089 . . . . 0.0 113.807 176.306 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -135.22 37.73 2.97 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 105.839 -1.911 . . . . 0.0 105.839 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -67.9 67.12 0.1 Allowed 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -171.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -71.3 -21.45 62.07 Favored 'General case' 0 CA--C 1.491 -1.31 0 C-N-CA 125.279 1.432 . . . . 0.0 108.573 172.452 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -45.17 -45.31 11.46 Favored 'General case' 0 C--O 1.207 -1.174 0 C-N-CA 124.63 1.172 . . . . 0.0 109.222 171.722 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 53.9 mt -67.4 -44.21 87.13 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.447 0 O-C-N 123.649 0.593 . . . . 0.0 109.483 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -59.14 -47.34 85.64 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 120.97 0.415 . . . . 0.0 111.152 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.83 -42.47 81.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.073 0.549 . . . . 0.0 110.286 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 559' ' ' TYR . . . . . 0.579 ' O ' HG12 ' A' ' 563' ' ' ILE . 93.4 t80 -53.6 -51.57 62.6 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.809 1.244 . . . . 0.0 108.763 173.504 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 9.6 t -55.07 -52.19 46.75 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.751 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.483 175.259 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -55.57 -38.01 68.78 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.34 0.656 . . . . 0.0 111.441 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 62.9 t -73.6 -32.93 37.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 177.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.579 HG12 ' O ' ' A' ' 559' ' ' TYR . 42.0 mm -90.59 -33.87 6.15 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.956 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -174.348 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -86.61 14.64 6.6 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 113.783 -1.553 . . . . 0.0 108.14 176.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -70.85 -19.76 62.61 Favored 'General case' 0 C--N 1.347 0.459 0 N-CA-C 105.494 -2.039 . . . . 0.0 105.494 169.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 566' ' ' LYS . . . . . 0.778 ' HE2' HE21 ' A' ' 469' ' ' GLN . 74.3 mmtt . . . . . 0 CA--C 1.548 0.878 0 CA-C-N 113.783 -1.553 . . . . 0.0 109.571 173.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 75.7 mt . . . . . 0 C--O 1.252 1.196 0 CA-C-O 120.92 0.39 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 20.0 m -99.5 133.66 43.5 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.255 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 36.5 ttm105 -60.01 -23.61 63.81 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.489 1.138 . . . . 0.0 109.255 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.583 ' O ' ' HG2' ' A' ' 473' ' ' GLU . 82.4 mt-30 -54.45 -38.14 66.01 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 126.4 1.88 . . . . 0.0 113.308 -177.523 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.498 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 1.8 tm-20 -68.45 -39.16 81.58 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.337 0.589 . . . . 0.0 109.629 -175.661 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -67.73 -33.5 74.99 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.992 175.679 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -70.19 -39.98 74.91 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.703 178.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 473' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 469' ' ' GLN . 6.6 mm-40 -60.88 -39.75 90.39 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.099 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.498 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 95.4 mtt180 -59.49 -47.2 86.43 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.898 176.566 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -65.36 -35.42 80.91 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.054 -178.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.63 -57.63 12.15 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.906 0.754 . . . . 0.0 109.42 179.165 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 27.3 mt -67.74 -31.61 71.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.553 -175.926 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.422 ' HG3' ' HB3' ' A' ' 542' ' ' LEU 0.281 23.3 mmmt -102.54 -5.86 23.49 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 116.917 2.191 . . . . 0.0 116.917 -175.603 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 24.7 m170 -99.4 -22.32 15.59 Favored 'General case' 0 CA--C 1.488 -1.437 0 C-N-CA 119.21 -0.996 . . . . 0.0 110.848 173.204 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 48.6 tp -115.98 102.26 9.5 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 24.0 mmt -67.49 -26.36 66.32 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 122.394 1.093 . . . . 0.0 108.253 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 482' ' ' ARG . . . . . 0.634 ' HA ' ' NE2' ' A' ' 520' ' ' GLN . 3.4 mpt_? -69.14 -7.1 33.04 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 113.707 -1.588 . . . . 0.0 113.858 176.737 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 483' ' ' ASP . . . . . 0.472 ' CG ' ' HB ' ' A' ' 486' ' ' THR . 3.4 t70 -71.4 56.8 0.25 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 122.517 1.151 . . . . 0.0 111.889 -176.751 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 484' ' ' LYS . . . . . 0.513 ' O ' ' HB3' ' A' ' 487' ' ' PHE . 82.3 tttt -93.77 -63.87 1.15 Allowed 'General case' 0 C--O 1.268 2.066 0 CA-C-O 123.066 1.412 . . . . 0.0 107.84 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -60.92 -46.18 91.68 Favored 'General case' 0 CA--C 1.491 -1.307 0 CA-C-N 113.546 -1.661 . . . . 0.0 108.059 175.424 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.472 ' HB ' ' CG ' ' A' ' 483' ' ' ASP . 1.3 m -62.16 -35.7 79.6 Favored 'General case' 0 C--O 1.189 -2.127 0 CA-C-N 114.251 -1.34 . . . . 0.0 110.957 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 487' ' ' PHE . . . . . 0.513 ' HB3' ' O ' ' A' ' 484' ' ' LYS . 7.4 t80 -51.35 -56.37 13.47 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.132 0.492 . . . . 0.0 110.708 174.436 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.58 -27.47 62.21 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 118.541 -1.264 . . . . 0.0 110.667 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -75.18 -32.22 61.19 Favored 'General case' 0 C--O 1.211 -0.964 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 490' ' ' TYR . . . . . 0.425 ' HD1' ' O ' ' A' ' 487' ' ' PHE . 0.0 OUTLIER -73.53 -37.68 65.53 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 -178.502 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 491' ' ' TYR . . . . . 0.507 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 4.0 t80 -65.42 -42.26 92.69 Favored 'General case' 0 N--CA 1.411 -2.424 0 CA-C-N 112.467 -2.151 . . . . 0.0 109.706 -177.212 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -81.6 -32.21 32.16 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.181 -176.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 35.1 m -83.45 -51.29 7.49 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.9 t -128.93 99.06 4.53 Favored 'Isoleucine or valine' 0 C--O 1.244 0.777 0 C-N-CA 118.067 -1.453 . . . . 0.0 113.363 -170.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 35.8 t70 34.26 87.04 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 127.701 2.4 . . . . 0.0 116.929 172.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 5.9 ptmt -90.14 -43.49 10.42 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 177.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.82 -61.53 2.55 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 -161.464 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -78.94 -10.99 59.98 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 118.769 -1.172 . . . . 0.0 110.723 -174.128 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -86.04 -17.02 36.33 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.778 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 30.3 m -63.02 113.73 3.27 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -174.067 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -94.49 150.06 20.63 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 171.718 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -57.88 -34.15 69.46 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.276 0.489 . . . . 0.0 111.025 -177.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 503' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 506' ' ' TYR . 82.8 t60 -64.99 -50.37 66.6 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 124.138 0.975 . . . . 0.0 109.726 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -64.65 -31.09 72.16 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.747 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -65.38 -35.61 81.48 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.473 ' CG ' HD11 ' A' ' 535' ' ' LEU . 12.0 m-85 -59.21 -43.47 92.26 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.686 173.442 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 9.7 t -61.73 -46.22 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 120.368 -0.533 . . . . 0.0 109.724 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -49.05 -44.44 41.72 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 123.406 0.441 . . . . 0.0 110.625 175.113 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -60.3 -48.28 82.43 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.035 -179.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.469 HG22 ' CE2' ' A' ' 529' ' ' TYR . 2.9 t -57.19 -43.49 81.82 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.847 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.739 ' HA ' ' HB3' ' A' ' 514' ' ' PHE . 94.7 mt -73.27 -34.27 65.71 Favored 'General case' 0 CA--C 1.565 1.544 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -176.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 30.3 t60 -67.43 -42.92 82.39 Favored 'General case' 0 C--O 1.259 1.566 0 CA-C-O 122.257 1.027 . . . . 0.0 108.541 174.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.65 -25.42 65.71 Favored 'General case' 0 C--O 1.172 -3.019 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.52 174.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 514' ' ' PHE . . . . . 0.882 ' O ' ' HA ' ' A' ' 518' ' ' ASN . 34.0 t80 -71.19 -16.39 62.52 Favored 'General case' 0 C--O 1.18 -2.58 0 C-N-CA 127.096 2.159 . . . . 0.0 111.459 174.97 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -79.85 -44.5 20.39 Favored 'General case' 0 C--N 1.28 -2.429 0 O-C-N 121.406 -0.809 . . . . 0.0 110.747 167.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.84 -53.48 32.09 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 123.119 1.438 . . . . 0.0 108.692 175.299 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 517' ' ' GLU . . . . . 0.452 ' O ' ' HA ' ' A' ' 514' ' ' PHE . 45.2 mt-10 -95.33 63.64 2.58 Favored 'General case' 0 C--N 1.281 -2.404 0 C-N-CA 129.003 2.921 . . . . 0.0 104.842 173.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 518' ' ' ASN . . . . . 0.882 ' HA ' ' O ' ' A' ' 514' ' ' PHE . 12.0 t-20 -59.32 -148.18 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.352 0 C-N-CA 129.886 3.275 . . . . 0.0 114.673 -164.346 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 519' ' ' ASP . . . . . 0.651 ' OD2' ' HG3' ' A' ' 520' ' ' GLN . 0.8 OUTLIER -34.07 -167.96 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.579 0 N-CA-C 120.079 3.363 . . . . 0.0 120.079 -136.817 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 520' ' ' GLN . . . . . 0.651 ' HG3' ' OD2' ' A' ' 519' ' ' ASP 0.313 59.0 mt-30 -59.44 135.68 57.74 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 120.941 3.682 . . . . 0.0 120.941 -146.456 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 521' ' ' TYR . . . . . 0.471 ' N ' ' HE1' ' A' ' 514' ' ' PHE . 5.2 t80 -41.61 133.37 2.67 Favored 'General case' 0 N--CA 1.416 -2.131 0 C-N-CA 131.09 3.756 . . . . 0.0 114.989 -177.181 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -119.25 163.91 16.42 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.336 172.23 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 5.7 tt -54.17 -32.83 23.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 C-N-CA 124.225 1.01 . . . . 0.0 111.002 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.56 ' HA ' HG12 ' A' ' 527' ' ' VAL . 34.8 p -59.48 -32.79 70.57 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.212 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -69.89 -44.07 70.49 Favored 'General case' 0 C--O 1.254 1.314 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -61.03 -51.4 69.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.869 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.56 HG12 ' HA ' ' A' ' 524' ' ' SER . 9.9 p -69.21 -13.62 17.47 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.0 0 C-N-CA 123.14 0.576 . . . . 0.0 110.747 177.788 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -69.71 -33.85 73.09 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.469 ' CE2' HG22 ' A' ' 510' ' ' VAL 0.256 1.0 OUTLIER -80.63 15.85 1.57 Allowed 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 172.392 . . . . . . . . 4 4 . 1 . 015 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.459 HG23 ' HG3' ' A' ' 536' ' ' ARG . 3.7 p -73.36 5.17 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.042 0 CA-C-O 121.699 0.761 . . . . 0.0 109.83 177.46 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -95.55 -14.76 23.34 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.702 0.801 . . . . 0.0 110.745 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 8.7 t -106.36 124.49 49.67 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 175.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -58.4 -44.04 88.84 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -170.266 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.25 -39.7 39.43 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -178.508 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.473 HD11 ' CG ' ' A' ' 506' ' ' TYR . 96.7 mt -67.36 -36.4 81.31 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-O 119.429 -0.32 . . . . 0.0 111.649 177.447 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.459 ' HG3' HG23 ' A' ' 530' ' ' VAL . 67.5 ttt180 -49.26 -67.53 0.26 Allowed 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 124.388 1.055 . . . . 0.0 110.522 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -62.13 -43.82 98.0 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.439 -176.993 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.46 ' O ' HD13 ' A' ' 542' ' ' LEU . 12.0 m -63.08 -54.62 35.16 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 120.217 -0.593 . . . . 0.0 112.542 -178.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.23 -37.01 85.55 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 38.5 mm -68.14 -38.87 80.38 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 70.1 m -57.03 -41.05 77.89 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.192 0.52 . . . . 0.0 110.741 171.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.484 HD21 ' HB3' ' A' ' 474' ' ' ARG . 7.8 mp -70.65 -24.77 62.77 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 123.198 0.599 . . . . 0.0 112.129 176.343 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -84.86 -35.87 21.93 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.658 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -71.33 29.51 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -176.584 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -61.93 148.67 42.9 Favored 'General case' 0 C--O 1.257 1.481 0 CA-C-O 121.707 0.765 . . . . 0.0 111.894 -175.187 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -84.04 -176.37 6.24 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.351 -171.143 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.428 ' C ' ' H ' ' A' ' 549' ' ' ASP . 7.4 mp -72.27 17.97 0.1 Allowed 'General case' 0 C--O 1.205 -1.253 0 C-N-CA 124.461 1.105 . . . . 0.0 112.458 -179.132 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 548' ' ' ASN . . . . . 0.406 ' C ' ' H ' ' A' ' 550' ' ' GLU . 17.0 m120 -75.04 20.83 0.13 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.149 0.98 . . . . 0.0 111.774 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 549' ' ' ASP . . . . . 0.428 ' H ' ' C ' ' A' ' 547' ' ' LEU . 25.1 t70 -72.69 33.06 0.07 Allowed 'General case' 0 CA--C 1.569 1.689 0 C-N-CA 125.972 1.709 . . . . 0.0 111.911 -176.51 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.406 ' H ' ' C ' ' A' ' 548' ' ' ASN . 17.0 mm-40 -73.94 170.54 14.09 Favored Pre-proline 0 C--N 1.304 -1.387 0 C-N-CA 124.852 1.261 . . . . 0.0 108.649 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -69.27 73.97 1.1 Allowed 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 121.862 1.708 . . . . 0.0 110.21 171.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -96.24 42.33 1.09 Allowed 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 126.495 1.918 . . . . 0.0 108.356 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 553' ' ' GLU . . . . . 0.585 ' O ' HG12 ' A' ' 556' ' ' ILE . 50.3 mt-10 -71.44 1.02 6.97 Favored 'General case' 0 C--N 1.281 -2.41 0 CA-C-N 114.633 -1.167 . . . . 0.0 112.464 -178.35 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -68.36 -21.47 64.72 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.956 1.702 . . . . 0.0 108.909 171.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -46.01 -49.18 16.39 Favored 'General case' 0 C--N 1.347 0.498 0 C-N-CA 124.065 0.946 . . . . 0.0 110.476 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 556' ' ' ILE . . . . . 0.585 HG12 ' O ' ' A' ' 553' ' ' GLU . 45.4 pt -64.67 -36.46 77.55 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 C-N-CA 123.342 0.657 . . . . 0.0 110.852 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.31 -50.9 71.09 Favored 'General case' 0 C--O 1.251 1.167 0 C-N-CA 123.533 0.733 . . . . 0.0 110.693 178.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 558' ' ' ASP . . . . . 0.441 ' O ' HG23 ' A' ' 562' ' ' VAL . 13.1 t70 -66.99 -42.89 84.3 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.733 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 559' ' ' TYR . . . . . 0.633 ' CZ ' HG13 ' A' ' 563' ' ' ILE . 52.9 t80 -54.19 -53.85 47.88 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.936 178.009 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 32.0 t -55.12 -47.46 77.22 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.383 0 C-N-CA 122.796 0.438 . . . . 0.0 111.537 -177.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.555 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 47.9 t30 -59.02 -47.24 85.94 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 122.342 0.257 . . . . 0.0 110.523 176.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 562' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 558' ' ' ASP . 83.1 t -63.8 -41.76 93.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 121.436 0.636 . . . . 0.0 111.877 -178.543 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.633 HG13 ' CZ ' ' A' ' 559' ' ' TYR . 50.4 mm -83.25 -33.9 10.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.016 0 CA-C-O 121.489 0.662 . . . . 0.0 109.866 -172.694 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -73.95 -12.15 60.56 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.277 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.555 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 34.3 mt-10 -63.43 -15.75 58.57 Favored 'General case' 0 C--N 1.362 1.151 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.737 174.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 95.9 mttt . . . . . 0 N--CA 1.489 1.501 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.339 175.161 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 6.7 mp . . . . . 0 N--CA 1.429 -1.494 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 48.4 m -75.32 106.0 6.63 Favored 'General case' 0 N--CA 1.42 -1.938 0 CA-C-O 121.554 0.692 . . . . 0.0 111.087 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -69.82 -16.16 63.23 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.404 175.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.454 HE21 HG23 ' A' ' 563' ' ' ILE . 52.6 mt-30 -59.66 -48.31 82.19 Favored 'General case' 0 C--O 1.189 -2.087 0 O-C-N 123.415 0.447 . . . . 0.0 110.075 173.811 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -60.0 -30.66 69.29 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-O 122.181 0.991 . . . . 0.0 109.887 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 28.3 mmtm -72.85 -32.13 65.24 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.374 174.242 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.49 -44.51 64.57 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.963 -178.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 473' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 477' ' ' LEU . 3.0 mp0 -55.6 -44.97 77.5 Favored 'General case' 0 C--N 1.349 0.581 0 O-C-N 123.349 0.406 . . . . 0.0 110.026 173.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -44.83 95.48 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -64.01 -51.19 65.38 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.752 0.31 . . . . 0.0 111.053 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -18.97 64.58 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-O 121.337 0.589 . . . . 0.0 111.758 -179.571 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.481 ' O ' HD13 ' A' ' 477' ' ' LEU . 3.0 tm? -77.25 -26.91 53.02 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 123.868 0.867 . . . . 0.0 110.423 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 33.8 tttm -53.65 -70.67 0.09 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.234 0.614 . . . . 0.0 111.012 -172.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.552 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 32.5 m80 61.54 -170.53 0.16 Allowed 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.962 0.905 . . . . 0.0 112.347 176.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 91.5 mt -115.11 175.54 5.46 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 167.332 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 481' ' ' MET . . . . . 0.42 ' HG3' ' O ' ' A' ' 521' ' ' TYR . 1.6 mpt? -73.6 -17.81 61.13 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 121.472 0.653 . . . . 0.0 110.282 -178.921 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -65.12 -35.03 79.84 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.802 175.631 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 483' ' ' ASP . . . . . 0.552 ' HB2' ' HB3' ' A' ' 479' ' ' HIS . 26.9 m-20 -70.85 52.79 0.15 Allowed 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 116.371 1.989 . . . . 0.0 116.371 -169.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -70.7 -42.45 70.63 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.118 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.83 -51.78 66.84 Favored 'General case' 0 CA--C 1.501 -0.938 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.797 177.112 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.514 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 6.0 m -59.73 -32.93 71.01 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.245 -177.768 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -59.94 -54.82 41.61 Favored 'General case' 0 C--N 1.347 0.464 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 173.026 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.98 -29.85 67.05 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.872 -178.116 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -65.02 -41.72 95.03 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 121.259 0.552 . . . . 0.0 109.794 -178.792 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -83.97 -37.91 21.66 Favored 'General case' 0 N--CA 1.411 -2.421 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.123 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -63.36 -40.08 96.29 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -73.63 -20.3 60.62 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.516 0.674 . . . . 0.0 110.305 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 39.4 m -79.02 -11.65 60.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.109 177.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 494' ' ' VAL . . . . . 0.503 HG13 ' HB2' ' A' ' 497' ' ' ASP . 55.1 t -94.97 129.85 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.234 0 CA-C-N 115.309 -0.859 . . . . 0.0 108.842 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -156.09 -60.37 0.1 Allowed 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.703 175.426 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -82.06 -19.68 39.79 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 122.103 0.954 . . . . 0.0 109.561 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 497' ' ' ASP . . . . . 0.503 ' HB2' HG13 ' A' ' 494' ' ' VAL . 0.6 OUTLIER -69.31 -0.9 6.89 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 126.203 1.801 . . . . 0.0 111.172 -177.523 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -75.59 19.6 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.295 0.638 . . . . 0.0 111.822 -179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.1 p90 -79.02 -16.99 56.11 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 173.737 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.6 t -58.96 168.41 1.3 Allowed 'General case' 0 CA--C 1.559 1.29 0 C-N-CA 124.843 1.257 . . . . 0.0 111.997 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -66.24 167.31 10.47 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -175.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -63.59 -12.84 36.31 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.572 1.549 . . . . 0.0 109.55 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -56.23 -44.34 79.51 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 124.721 1.208 . . . . 0.0 109.243 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -60.49 -34.87 74.69 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.954 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -70.12 -43.88 70.06 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -176.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.5 ' O ' HG23 ' A' ' 510' ' ' VAL . 73.9 m-85 -59.89 -46.16 90.21 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.448 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 507' ' ' VAL . . . . . 0.462 HG21 ' HG ' ' A' ' 477' ' ' LEU . 27.1 m -71.07 -47.17 63.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-O 118.916 -0.564 . . . . 0.0 112.282 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -51.53 -48.87 62.86 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 123.585 0.553 . . . . 0.0 111.835 176.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.91 -52.07 65.41 Favored 'General case' 0 C--O 1.242 0.694 0 O-C-N 124.029 0.83 . . . . 0.0 110.346 -178.433 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 506' ' ' TYR . 79.0 t -60.18 -50.85 78.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.311 178.067 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 92.5 mt -58.53 -55.77 30.78 Favored 'General case' 0 C--O 1.198 -1.625 0 O-C-N 124.078 0.861 . . . . 0.0 111.741 -176.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -59.95 -39.06 84.28 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.57 0.544 . . . . 0.0 111.694 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -66.04 -51.43 58.29 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.645 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -71.3 -39.29 71.55 Favored 'General case' 0 C--O 1.176 -2.804 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.871 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -53.19 -39.39 63.61 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 122.773 0.429 . . . . 0.0 110.419 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.15 -37.54 78.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -123.01 -2.31 8.7 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -171.11 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -150.2 -151.36 0.39 Allowed 'General case' 0 C--N 1.274 -2.698 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 -172.102 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.43 -163.71 1.08 Allowed 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 124.708 1.203 . . . . 0.0 111.868 -173.102 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.64 160.52 14.22 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 521' ' ' TYR . . . . . 0.42 ' O ' ' HG3' ' A' ' 481' ' ' MET . 4.0 t80 -41.74 132.2 3.01 Favored 'General case' 0 N--CA 1.415 -2.193 0 C-N-CA 126.816 2.046 . . . . 0.0 115.453 -179.195 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -116.83 159.15 22.79 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 171.015 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.4 pp -77.17 -18.91 14.37 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 CA-C-O 121.805 0.812 . . . . 0.0 108.819 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.504 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 8.0 m -57.14 -36.63 70.94 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.095 172.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -64.21 -38.34 90.69 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.343 0.592 . . . . 0.0 109.7 -179.179 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.49 ' O ' HG13 ' A' ' 530' ' ' VAL . . . -60.95 -46.9 88.86 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.814 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 530' ' ' VAL . 82.7 t -61.95 -36.55 74.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 124.715 1.206 . . . . 0.0 111.444 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 528' ' ' GLN . . . . . 0.504 ' HG3' ' O ' ' A' ' 524' ' ' SER . 77.9 mt-30 -62.86 -36.08 82.08 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.651 0.739 . . . . 0.0 110.067 178.03 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.541 ' CG ' ' HD3' ' A' ' 536' ' ' ARG . 0.3 OUTLIER -76.15 -15.01 60.15 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.68 -176.755 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 527' ' ' VAL . 17.3 m -86.19 18.29 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 N-CA-C 116.037 1.865 . . . . 0.0 116.037 -170.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -96.99 -27.23 14.71 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 105.588 -2.005 . . . . 0.0 105.588 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 532' ' ' SER . . . . . 0.401 ' C ' ' H ' ' A' ' 534' ' ' GLU . 14.9 m -92.8 -142.33 0.21 Allowed 'General case' 0 C--N 1.292 -1.923 0 C-N-CA 128.871 2.868 . . . . 0.0 107.007 174.038 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 533' ' ' ASN . . . . . 0.429 ' O ' ' N ' ' A' ' 535' ' ' LEU . 13.4 m120 -29.08 28.08 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.851 1 C-N-CA 136.365 5.866 . . . . 0.0 117.559 173.161 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 534' ' ' GLU . . . . . 0.712 ' O ' ' HG3' ' A' ' 537' ' ' GLU . 10.4 pt-20 -33.28 2.27 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.633 0 C-N-CA 131.32 3.848 . . . . 0.0 116.348 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.455 ' O ' ' HB ' ' A' ' 538' ' ' THR . 3.1 pp -64.93 -17.19 64.14 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 162.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.541 ' HD3' ' CG ' ' A' ' 529' ' ' TYR . 21.0 ttt180 -80.52 -11.99 59.59 Favored 'General case' 0 N--CA 1.402 -2.855 0 CA-C-N 113.149 -1.841 . . . . 0.0 111.288 174.274 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 537' ' ' GLU . . . . . 0.712 ' HG3' ' O ' ' A' ' 534' ' ' GLU . 0.1 OUTLIER -79.15 -32.35 44.3 Favored 'General case' 0 CA--C 1.475 -1.909 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 171.921 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.455 ' HB ' ' O ' ' A' ' 535' ' ' LEU . 62.4 m -59.54 -43.22 93.54 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 114.663 -1.153 . . . . 0.0 109.189 170.328 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 11.2 tp -56.75 -40.51 75.92 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.136 175.224 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 540' ' ' ILE . . . . . 0.479 HD11 ' HA ' ' A' ' 527' ' ' VAL . 80.6 mt -61.17 -49.24 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 C-N-CA 122.81 0.444 . . . . 0.0 110.391 176.071 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.4 m -54.26 -43.23 70.8 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.854 0.835 . . . . 0.0 110.668 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 34.5 tp -72.75 -25.4 61.18 Favored 'General case' 0 CA--C 1.565 1.556 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.208 177.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -79.73 -28.09 40.54 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.717 1.207 . . . . 0.0 109.656 -178.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -68.45 -27.49 66.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.739 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -65.76 115.01 5.45 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.177 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 546' ' ' ASN . . . . . 0.438 ' ND2' ' HB2' ' A' ' 549' ' ' ASP . 58.1 t30 -109.06 82.56 1.61 Allowed 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.317 -174.757 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -84.48 -15.4 46.14 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.735 176.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -78.71 -3.1 42.53 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.443 -178.491 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 549' ' ' ASP . . . . . 0.438 ' HB2' ' ND2' ' A' ' 546' ' ' ASN . 19.0 t70 -62.57 -44.06 97.27 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.903 0.859 . . . . 0.0 109.187 176.162 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -85.34 156.87 59.51 Favored Pre-proline 0 C--N 1.291 -1.956 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -50.89 112.03 0.68 Allowed 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 122.277 1.984 . . . . 0.0 108.816 173.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -118.46 31.81 6.47 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.636 0.731 . . . . 0.0 110.109 -169.571 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -70.91 -6.09 35.75 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.677 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -66.34 -20.73 66.16 Favored 'General case' 0 C--O 1.214 -0.79 0 C-N-CA 124.984 1.314 . . . . 0.0 109.617 171.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 555' ' ' GLU . . . . . 0.415 ' HG3' HG13 ' A' ' 556' ' ' ILE . 8.8 pt-20 -37.78 -54.29 1.24 Allowed 'General case' 0 C--O 1.204 -1.306 0 C-N-CA 123.798 0.839 . . . . 0.0 113.026 179.733 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 556' ' ' ILE . . . . . 0.415 HG13 ' HG3' ' A' ' 555' ' ' GLU . 20.5 mt -67.61 -42.64 86.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -176.592 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -56.06 -52.46 64.17 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.898 0.748 . . . . 0.0 110.121 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -65.03 -57.88 7.52 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.745 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -50.99 -54.14 27.08 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 124.932 1.293 . . . . 0.0 112.615 -176.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.1 t -71.52 -40.65 72.0 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.386 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.594 -176.672 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -60.29 -34.82 74.3 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 117.959 0.345 . . . . 0.0 110.686 178.7 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.26 -36.5 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 121.383 0.611 . . . . 0.0 111.907 177.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.454 HG23 HE21 ' A' ' 469' ' ' GLN . 60.2 mt -84.63 -36.5 11.62 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.01 0 CA-C-O 122.204 1.002 . . . . 0.0 108.328 -176.09 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -81.56 7.21 12.68 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.348 176.34 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -71.66 -20.3 61.97 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 172.037 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp . . . . . 0 CA--C 1.55 0.98 0 CA-C-N 113.925 -1.489 . . . . 0.0 107.383 172.327 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 7.1 mp . . . . . 0 N--CA 1.444 -0.773 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 18.4 m -71.06 135.58 47.82 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -174.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 19.6 mmt85 -60.12 -38.79 84.09 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 123.138 1.447 . . . . 0.0 107.199 173.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.572 ' HG3' ' HA ' ' A' ' 563' ' ' ILE . 18.3 mp0 -64.14 -21.76 66.67 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 112.768 -2.015 . . . . 0.0 111.555 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.66 ' O ' ' HG2' ' A' ' 474' ' ' ARG . 55.3 tt0 -66.28 -40.79 90.32 Favored 'General case' 0 C--O 1.209 -1.047 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -62.58 -41.53 99.0 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -58.17 -46.26 86.04 Favored 'General case' 0 C--O 1.243 0.738 0 O-C-N 123.675 0.609 . . . . 0.0 109.89 175.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -57.57 -50.29 73.59 Favored 'General case' 0 C--O 1.2 -1.548 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.957 175.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.66 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 18.7 mmm-85 -59.18 -32.0 69.51 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 120.77 0.319 . . . . 0.0 110.327 -178.108 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -66.02 -57.59 7.41 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 476' ' ' PHE . . . . . 0.416 ' HB3' ' HB2' ' A' ' 490' ' ' TYR . 1.4 m-85 -62.53 -35.4 79.31 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 178.485 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 25.8 tp -73.17 -9.0 58.25 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 124.941 1.296 . . . . 0.0 112.352 -176.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -46.51 -40.04 11.85 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.207 1.003 . . . . 0.0 113.577 -179.257 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.956 ' HA ' HG21 ' A' ' 486' ' ' THR 0.256 0.3 OUTLIER 84.76 130.15 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 126.574 1.949 . . . . 0.0 111.753 -177.153 . . . . . . . . 4 4 . 1 . 017 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -93.42 -96.25 0.15 Allowed 'General case' 0 N--CA 1.427 -1.591 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.406 175.188 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 481' ' ' MET . . . . . . . . . . . . 0.398 0.5 OUTLIER -95.84 -91.37 0.22 Allowed 'General case' 0 CA--C 1.472 -2.04 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 179.905 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 482' ' ' ARG . . . . . 0.603 ' HB3' ' O ' ' A' ' 519' ' ' ASP . 12.6 mtm180 -79.04 -100.33 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.668 0 C-N-CA 116.689 -2.004 . . . . 0.0 111.202 -174.405 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 483' ' ' ASP . . . . . 0.593 ' HB3' ' HB2' ' A' ' 519' ' ' ASP . 10.1 t70 -142.46 -54.72 0.43 Allowed 'General case' 0 C--N 1.296 -1.74 0 C-N-CA 123.453 0.701 . . . . 0.0 109.262 173.927 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 34.3 tttm -34.53 -66.45 0.17 Allowed 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 113.046 -1.888 . . . . 0.0 113.746 -170.43 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -58.95 -52.9 63.79 Favored 'General case' 0 C--O 1.202 -1.442 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.546 -173.364 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.956 HG21 ' HA ' ' A' ' 479' ' ' HIS . 93.8 m -61.03 -48.15 83.09 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.778 -177.902 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -54.92 -59.09 5.21 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 124.431 1.082 . . . . 0.0 108.959 -177.036 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 85.0 mt -68.65 -27.64 66.18 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.421 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -64.36 -30.8 71.83 Favored 'General case' 0 CA--C 1.489 -1.375 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 490' ' ' TYR . . . . . 0.448 ' O ' HG23 ' A' ' 494' ' ' VAL . 2.0 t80 -95.53 -53.43 3.74 Favored 'General case' 1 N--CA 1.367 -4.613 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 176.484 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -63.96 -40.24 95.95 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 124.747 1.219 . . . . 0.0 114.146 -167.64 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -81.93 -10.68 59.2 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.436 0.636 . . . . 0.0 112.17 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 17.8 m -84.84 -11.76 54.98 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.05 176.209 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 494' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 490' ' ' TYR . 23.9 t -113.72 109.39 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.863 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.256 -176.824 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -95.23 -17.1 22.0 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -89.56 20.61 3.86 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 113.329 -1.76 . . . . 0.0 111.647 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -58.51 -6.9 0.78 Allowed 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -174.168 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -79.57 -9.82 59.69 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 120.898 -1.126 . . . . 0.0 110.58 176.87 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -82.22 -9.41 59.51 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.783 176.511 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 20.4 p -56.14 160.91 2.66 Favored 'General case' 0 C--O 1.25 1.103 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -174.586 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.712 ' OD1' ' HB2' ' A' ' 503' ' ' HIS . 8.0 p30 -91.64 161.73 14.79 Favored 'General case' 0 N--CA 1.416 -2.145 0 CA-C-N 114.03 -1.441 . . . . 0.0 111.03 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -77.42 -23.31 50.62 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.571 0.7 . . . . 0.0 109.623 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 503' ' ' HIS . . . . . 0.712 ' HB2' ' OD1' ' A' ' 501' ' ' ASN . 32.3 m170 -61.42 -46.24 90.94 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 175.724 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 504' ' ' PHE . . . . . 0.429 ' CE1' ' CE1' ' A' ' 490' ' ' TYR . 72.2 t80 -57.65 -35.43 70.53 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.266 -1.334 . . . . 0.0 111.197 173.353 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -63.93 -48.85 74.94 Favored 'General case' 0 CA--C 1.482 -1.652 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -175.463 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.495 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.2 OUTLIER -61.32 -37.67 84.09 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 118.283 -1.367 . . . . 0.0 110.17 -179.076 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 507' ' ' VAL . . . . . 0.462 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 23.3 t -66.85 -54.53 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 120.291 -0.563 . . . . 0.0 110.785 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -48.97 -39.87 28.23 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.849 0.86 . . . . 0.0 110.873 176.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -59.52 -56.34 23.2 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.362 1.065 . . . . 0.0 110.376 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 506' ' ' TYR . 2.5 t -64.44 -41.16 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.445 178.376 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 83.7 mt -58.75 -53.78 54.49 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.251 0.548 . . . . 0.0 111.488 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -62.82 -32.13 73.27 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.695 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.32 -40.98 98.12 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 120.773 0.321 . . . . 0.0 110.254 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 514' ' ' PHE . . . . . 0.446 ' CE2' HG12 ' A' ' 510' ' ' VAL . 33.4 m-85 -69.11 -57.09 5.86 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -49.03 -34.53 13.56 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.893 1.277 . . . . 0.0 111.307 -178.488 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.06 -23.97 66.63 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -112.38 -58.01 2.2 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.45 0.643 . . . . 0.0 110.021 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -158.01 121.54 4.01 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 125.345 1.458 . . . . 0.0 108.352 175.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 519' ' ' ASP . . . . . 0.603 ' O ' ' HB3' ' A' ' 482' ' ' ARG . 1.9 p30 -77.78 98.72 5.64 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-O 121.064 0.459 . . . . 0.0 111.698 -172.231 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -143.04 140.97 31.19 Favored 'General case' 0 CA--C 1.491 -1.315 0 O-C-N 121.437 -0.79 . . . . 0.0 110.938 167.826 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -85.0 105.9 16.1 Favored 'General case' 0 N--CA 1.402 -2.864 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 170.413 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -85.5 110.41 19.18 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -177.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 5.0 tt -55.85 -33.32 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 C-N-CA 124.58 1.152 . . . . 0.0 110.907 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.581 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 48.1 t -58.34 -38.64 77.56 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.083 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -65.26 -43.57 90.84 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -58.11 -52.47 65.43 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.137 179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.587 ' HA ' HG13 ' A' ' 530' ' ' VAL . 8.9 p -67.77 -24.02 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 CA-C-O 121.063 0.459 . . . . 0.0 111.88 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 528' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 524' ' ' SER . 78.0 mt-30 -67.65 -26.62 66.31 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 121.144 -0.972 . . . . 0.0 109.484 172.879 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 526' ' ' ALA . 47.5 m-85 -75.01 -0.49 19.0 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 118.136 -0.935 . . . . 0.0 112.659 174.416 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.637 ' HA ' ' NH1' ' A' ' 536' ' ' ARG . 32.3 m -72.37 20.88 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.532 3.666 0 N-CA-C 116.589 2.07 . . . . 0.0 116.589 -173.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -128.99 -40.5 1.5 Allowed 'General case' 0 C--N 1.278 -2.521 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 173.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.58 -144.62 0.03 OUTLIER 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 128.729 2.812 . . . . 0.0 112.062 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 533' ' ' ASN . . . . . 0.497 ' C ' ' H ' ' A' ' 535' ' ' LEU . 45.3 t30 -27.8 31.42 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 1 C-N-CA 138.496 6.719 . . . . 0.0 117.578 176.817 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -31.76 8.87 0.0 OUTLIER 'General case' 0 N--CA 1.536 3.854 0 C-N-CA 130.992 3.717 . . . . 0.0 117.045 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.497 ' H ' ' C ' ' A' ' 533' ' ' ASN . 45.5 mt -63.76 -26.84 68.82 Favored 'General case' 0 C--N 1.283 -2.295 0 N-CA-C 103.167 -2.901 . . . . 0.0 103.167 162.766 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.637 ' NH1' ' HA ' ' A' ' 530' ' ' VAL . 1.4 ttp180 -56.27 -39.55 72.81 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 111.887 -2.415 . . . . 0.0 110.985 169.094 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -60.96 -47.04 88.28 Favored 'General case' 0 CA--C 1.481 -1.706 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 -179.044 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.472 ' O ' HD13 ' A' ' 542' ' ' LEU . 24.4 m -55.81 -48.15 75.91 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 114.295 -1.32 . . . . 0.0 109.832 174.853 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 539' ' ' LEU . . . . . 0.552 ' O ' ' HB2' ' A' ' 542' ' ' LEU . 9.3 tt -60.54 -36.71 79.09 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 540' ' ' ILE . . . . . 0.484 HG12 ' O ' ' A' ' 536' ' ' ARG . 50.1 mm -66.88 -34.27 68.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 178.222 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 541' ' ' SER . . . . . 0.443 ' HB3' ' O ' ' A' ' 538' ' ' THR . 29.7 t -57.32 -40.01 77.0 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.104 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.552 ' HB2' ' O ' ' A' ' 539' ' ' LEU . 6.3 mp -60.58 -33.63 73.0 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.527 0.731 . . . . 0.0 109.955 175.665 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -80.08 -31.11 39.36 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -69.71 -33.65 72.8 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -64.01 114.05 3.88 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.256 170.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -107.1 138.22 43.68 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.247 -175.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.558 ' H ' HD23 ' A' ' 547' ' ' LEU . 2.1 pt? -79.8 9.5 5.15 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.288 1.042 . . . . 0.0 110.511 177.618 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -68.81 -41.41 78.69 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.703 -1.135 . . . . 0.0 108.542 174.338 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -68.36 -60.52 2.38 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.744 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -125.21 119.78 25.12 Favored Pre-proline 0 N--CA 1.425 -1.723 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.276 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 551' ' ' PRO . . . . . 0.486 ' HB2' ' OE1' ' A' ' 553' ' ' GLU . 29.9 Cg_endo -63.49 -169.91 0.1 Allowed 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.233 2.622 . . . . 0.0 114.065 -177.707 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 552' ' ' TYR . . . . . 0.443 ' O ' HG13 ' A' ' 556' ' ' ILE . 47.1 p90 -91.55 -13.65 31.68 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -170.729 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 553' ' ' GLU . . . . . 0.486 ' OE1' ' HB2' ' A' ' 551' ' ' PRO . 2.0 mp0 -66.9 -42.86 84.75 Favored 'General case' 0 C--N 1.28 -2.435 0 CA-C-O 121.304 0.573 . . . . 0.0 110.416 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -69.16 -24.07 64.03 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.551 175.121 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 555' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 551' ' ' PRO . 54.9 mt-10 -72.39 -46.78 53.72 Favored 'General case' 0 C--O 1.211 -0.927 0 C-N-CA 120.054 -0.658 . . . . 0.0 109.408 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 556' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 552' ' ' TYR . 64.8 mt -58.79 -49.17 83.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.116 0.566 . . . . 0.0 110.865 178.078 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -60.31 -52.53 64.88 Favored 'General case' 0 CA--C 1.508 -0.638 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.58 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -60.24 -43.35 96.17 Favored 'General case' 0 C--O 1.207 -1.161 0 O-C-N 123.862 0.726 . . . . 0.0 110.611 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 559' ' ' TYR . . . . . 0.442 ' O ' HG13 ' A' ' 563' ' ' ILE . 50.4 t80 -54.43 -53.56 52.47 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 124.473 1.109 . . . . 0.0 110.813 176.446 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.9 t -65.21 -42.33 93.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.569 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -62.4 -42.43 99.42 Favored 'General case' 0 C--O 1.194 -1.861 0 C-N-CA 123.456 0.702 . . . . 0.0 110.087 -179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 562' ' ' VAL . . . . . 0.585 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 40.9 t -64.89 -41.21 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 CA-C-O 121.656 0.741 . . . . 0.0 112.679 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.572 ' HA ' ' HG3' ' A' ' 469' ' ' GLN . 54.1 mt -76.32 -35.85 28.3 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.224 0 CA-C-O 122.136 0.969 . . . . 0.0 109.462 -174.778 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -90.93 -6.82 53.58 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.0 -176.728 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 11.8 pt-20 -76.6 -25.03 53.48 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.246 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt . . . . . 0 C--N 1.322 -0.624 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.325 176.661 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 50.5 mt . . . . . 0 C--O 1.238 0.452 0 CA-C-O 121.027 0.441 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 68.8 p -75.05 178.64 5.51 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.125 -175.064 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 468' ' ' ARG . . . . . 0.463 ' NH2' HG22 ' A' ' 562' ' ' VAL . 8.1 ptm85 -60.18 -40.94 91.77 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.54 ' NE2' ' HA ' ' A' ' 563' ' ' ILE . 67.0 mt-30 -70.36 -30.02 66.84 Favored 'General case' 0 C--O 1.212 -0.88 0 C-N-CA 119.041 -1.064 . . . . 0.0 111.429 176.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.533 ' HG2' HG22 ' A' ' 500' ' ' THR . 48.5 mt-10 -70.72 -35.19 72.61 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 120.777 0.323 . . . . 0.0 111.104 176.944 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.489 ' HD3' ' HA ' ' A' ' 471' ' ' LYS . 20.5 mmtp -66.93 -33.45 75.61 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.834 173.29 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.0 -47.17 60.35 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.91 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 473' ' ' GLU . . . . . 0.404 ' OE2' HG21 ' A' ' 494' ' ' VAL . 5.0 mm-40 -61.44 -44.44 97.1 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 120.515 0.198 . . . . 0.0 110.617 176.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.497 ' NE ' ' HB3' ' A' ' 542' ' ' LEU . 11.7 tpt180 -54.88 -42.23 71.84 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.778 173.887 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 475' ' ' ALA . . . . . 0.455 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . . . -64.43 -44.93 89.64 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-O 120.799 0.333 . . . . 0.0 110.692 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.24 -18.69 64.78 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.2 mt -71.08 -15.96 62.55 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 121.953 -0.467 . . . . 0.0 112.07 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.455 ' HE3' ' HA ' ' A' ' 475' ' ' ALA . 10.0 mtmp? -77.78 26.15 0.19 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 122.984 0.514 . . . . 0.0 111.747 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 -86.88 14.0 8.03 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 122.881 0.472 . . . . 0.0 111.959 -175.164 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 97.1 mt 71.35 -174.55 0.17 Allowed 'General case' 0 C--O 1.245 0.863 0 C-N-CA 123.754 0.821 . . . . 0.0 110.729 -177.459 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 59.0 ttp -88.26 -36.31 16.79 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.86 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 25.2 ttp180 -57.48 -46.67 83.43 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.914 1.286 . . . . 0.0 114.313 -173.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.3 59.29 0.27 Allowed 'General case' 0 C--N 1.28 -2.422 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -171.59 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -57.55 -36.76 72.06 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 124.319 1.047 . . . . 0.0 111.54 177.214 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -57.19 -44.05 83.24 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.117 0.484 . . . . 0.0 109.702 176.604 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 28.9 m -64.6 -31.63 72.93 Favored 'General case' 0 N--CA 1.421 -1.911 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.231 -178.981 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -61.03 -50.93 71.33 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 488' ' ' LEU . . . . . 0.467 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 76.1 mt -74.33 -36.75 63.68 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.514 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -61.32 -42.96 99.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.276 0.63 . . . . 0.0 112.431 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -78.57 -38.58 39.91 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.636 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -55.19 -49.28 72.31 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.82 178.647 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 492' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 12.6 pt-20 -79.29 -7.69 58.49 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -177.769 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 68.9 m -81.4 -14.88 56.65 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 122.121 0.962 . . . . 0.0 109.132 174.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 494' ' ' VAL . . . . . 0.578 HG13 ' HB2' ' A' ' 497' ' ' ASP . 33.1 t -100.08 133.78 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.376 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -149.5 -56.63 0.19 Allowed 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -88.46 -22.38 23.71 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 122.727 1.251 . . . . 0.0 108.347 178.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 497' ' ' ASP . . . . . 0.578 ' HB2' HG13 ' A' ' 494' ' ' VAL . 0.0 OUTLIER -72.96 -2.88 22.73 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 126.689 1.996 . . . . 0.0 109.365 178.191 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -77.68 22.51 0.26 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.147 0.979 . . . . 0.0 109.855 -176.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 499' ' ' PHE . . . . . 0.476 ' HE1' ' OE1' ' A' ' 469' ' ' GLN . 31.5 p90 -77.68 -9.75 59.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 500' ' ' THR . . . . . 0.533 HG22 ' HG2' ' A' ' 470' ' ' GLU . 1.1 p -54.48 166.97 0.37 Allowed 'General case' 0 N--CA 1.426 -1.661 0 C-N-CA 125.999 1.72 . . . . 0.0 115.115 -173.959 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.453 ' HB2' ' OE2' ' A' ' 470' ' ' GLU . 16.0 t-20 -64.38 146.99 53.57 Favored 'General case' 0 N--CA 1.429 -1.511 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.024 -175.042 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -64.05 -15.43 59.47 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-O 120.97 0.414 . . . . 0.0 111.306 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 503' ' ' HIS . . . . . 0.495 ' NE2' ' HG ' ' A' ' 535' ' ' LEU . 66.6 m170 -65.54 -39.03 91.28 Favored 'General case' 0 C--O 1.203 -1.36 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.448 176.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -63.89 -36.62 84.54 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.508 0.67 . . . . 0.0 110.32 176.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -68.11 -41.33 81.91 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.783 176.545 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 506' ' ' TYR . . . . . 0.459 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -60.81 -40.37 92.45 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.19 177.29 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 507' ' ' VAL . . . . . 0.464 ' O ' HD13 ' A' ' 511' ' ' LEU . 77.1 t -56.42 -56.47 13.48 Favored 'Isoleucine or valine' 0 C--N 1.341 0.217 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 173.622 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -45.62 -52.53 10.54 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 123.96 0.787 . . . . 0.0 111.747 174.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.47 -60.09 4.17 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 123.812 0.845 . . . . 0.0 112.539 -177.934 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 510' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 506' ' ' TYR . 17.0 t -60.78 -43.71 95.9 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 CA-C-O 120.512 0.196 . . . . 0.0 110.99 -176.327 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.464 HD13 ' O ' ' A' ' 507' ' ' VAL . 10.8 mp -63.32 -49.66 73.08 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.062 -178.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -64.18 -35.9 82.29 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 123.86 0.725 . . . . 0.0 110.856 -177.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -60.98 -44.28 97.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.822 0.344 . . . . 0.0 111.523 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -74.48 -47.21 34.64 Favored 'General case' 0 C--O 1.183 -2.409 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 515' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 14.6 t80 -47.83 -37.41 13.75 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 125.674 1.59 . . . . 0.0 110.777 -179.407 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.56 -40.09 88.84 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -115.87 -40.6 3.31 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -172.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -106.02 -151.57 0.46 Allowed 'General case' 0 C--N 1.271 -2.83 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 519' ' ' ASP . . . . . 0.403 ' CG ' ' H ' ' A' ' 520' ' ' GLN . 13.7 t70 -105.17 -160.11 0.74 Allowed 'General case' 0 C--N 1.285 -2.228 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -177.331 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 520' ' ' GLN . . . . . 0.403 ' H ' ' CG ' ' A' ' 519' ' ' ASP . 88.2 mt-30 -78.04 166.86 22.3 Favored 'General case' 0 C--N 1.296 -1.753 0 C-N-CA 123.164 0.585 . . . . 0.0 112.359 -174.147 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -90.07 134.38 34.29 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 125.314 1.445 . . . . 0.0 111.511 -172.835 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.14 176.24 5.4 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.105 177.455 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 523' ' ' ILE . . . . . 0.601 HD13 ' H ' ' A' ' 523' ' ' ILE 0.303 0.2 OUTLIER -78.95 -14.16 13.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 119.25 -0.98 . . . . 0.0 113.379 -175.859 . . . . . . . . 4 4 . 1 . 018 nuclear build core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 40.9 m -60.37 -36.0 77.03 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 121.228 0.537 . . . . 0.0 109.589 169.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -66.03 -43.32 87.92 Favored 'General case' 0 C--O 1.253 1.286 0 CA-C-O 122.362 1.077 . . . . 0.0 108.207 176.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.465 ' O ' ' HD3' ' A' ' 536' ' ' ARG . . . -56.15 -52.54 64.01 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 113.675 -1.602 . . . . 0.0 111.658 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.694 ' O ' HG12 ' A' ' 530' ' ' VAL . 8.0 p -64.46 -30.67 50.83 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.928 0 CA-C-O 120.546 0.212 . . . . 0.0 111.026 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 81.3 mm-40 -66.83 -22.94 65.99 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.404 -0.81 . . . . 0.0 110.474 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.14 -3.18 41.18 Favored 'General case' 0 N--CA 1.441 -0.916 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 174.543 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.694 HG12 ' O ' ' A' ' 527' ' ' VAL 0.267 8.9 p -74.67 53.84 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.553 0 CA-C-O 122.918 1.342 . . . . 0.0 113.267 179.039 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -107.16 -33.99 7.27 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.238 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 14.7 t -91.77 109.23 20.55 Favored 'General case' 0 N--CA 1.421 -1.893 0 N-CA-C 102.278 -3.23 . . . . 0.0 102.278 163.772 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 20.5 m120 -62.62 -68.2 0.35 Allowed 'General case' 0 C--O 1.203 -1.369 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 -170.328 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -37.44 23.71 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 114.398 1.259 . . . . 0.0 114.398 -177.738 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.495 ' HG ' ' NE2' ' A' ' 503' ' ' HIS . 6.6 tt -62.06 -68.01 0.36 Allowed 'General case' 0 C--O 1.266 1.928 0 C-N-CA 124.19 0.996 . . . . 0.0 109.897 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.465 ' HD3' ' O ' ' A' ' 526' ' ' ALA . 3.7 tpm_? -69.86 -31.29 69.05 Favored 'General case' 0 N--CA 1.412 -2.33 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.843 -175.9 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -56.06 -58.34 8.35 Favored 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.9 0.75 . . . . 0.0 110.056 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 75.5 m -56.38 -49.04 75.58 Favored 'General case' 0 N--CA 1.443 -0.808 0 O-C-N 123.484 0.49 . . . . 0.0 111.018 178.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 20.1 tp -62.73 -32.81 74.0 Favored 'General case' 0 CA--C 1.568 1.648 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.837 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 24.1 mm -68.39 -41.39 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 174.817 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 19.5 m -55.35 -48.65 73.91 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.593 0.711 . . . . 0.0 109.597 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.497 ' HB3' ' NE ' ' A' ' 474' ' ' ARG . 7.8 mp -66.5 -19.69 65.85 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.112 178.07 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -87.89 -35.34 17.78 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 122.766 0.426 . . . . 0.0 111.927 175.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -69.46 -40.51 77.1 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.163 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -72.06 115.92 11.85 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 121.552 0.691 . . . . 0.0 111.591 173.944 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -98.31 93.67 6.34 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.607 -172.07 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 6.6 mp -83.0 -17.22 44.15 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.775 177.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -77.16 9.17 3.25 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -176.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -69.84 -21.99 63.32 Favored 'General case' 0 CA--C 1.495 -1.149 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 168.046 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -88.11 121.49 70.5 Favored Pre-proline 0 N--CA 1.411 -2.395 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.02 105.54 0.17 Allowed 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.151 1.901 . . . . 0.0 108.623 173.466 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 552' ' ' TYR . . . . . 0.655 ' HB2' ' HB3' ' A' ' 555' ' ' GLU . 4.2 p90 -77.25 40.11 0.26 Allowed 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 -168.833 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.82 -48.04 64.56 Favored 'General case' 0 C--N 1.266 -3.046 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.603 -179.414 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -69.07 -27.22 65.43 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.736 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 555' ' ' GLU . . . . . 0.655 ' HB3' ' HB2' ' A' ' 552' ' ' TYR . 29.6 tt0 -68.85 -38.39 79.76 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.237 -177.238 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 556' ' ' ILE . . . . . 0.593 HG13 ' O ' ' A' ' 552' ' ' TYR . 62.5 mt -64.52 -45.57 95.26 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.332 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 176.149 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -59.57 -43.24 93.67 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 120.887 0.375 . . . . 0.0 110.686 178.249 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 558' ' ' ASP . . . . . 0.571 ' O ' HG23 ' A' ' 562' ' ' VAL . 27.5 t70 -62.54 -55.24 29.2 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.812 175.165 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 559' ' ' TYR . . . . . 0.437 ' O ' HG12 ' A' ' 563' ' ' ILE . 40.6 t80 -48.28 -53.02 18.73 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 125.426 1.49 . . . . 0.0 110.759 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 48.6 t -55.99 -50.98 66.32 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.798 0 O-C-N 124.04 0.837 . . . . 0.0 109.524 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.546 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 58.5 t30 -57.95 -42.77 85.64 Favored 'General case' 0 C--O 1.193 -1.915 0 CA-C-N 117.788 0.267 . . . . 0.0 110.812 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 562' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 558' ' ' ASP . 99.1 t -62.47 -36.39 74.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 C-N-CA 124.031 0.933 . . . . 0.0 112.403 -178.585 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.54 ' HA ' ' NE2' ' A' ' 469' ' ' GLN . 50.8 mm -88.08 -41.86 14.58 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.929 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 -173.666 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -85.38 18.02 2.88 Favored 'General case' 0 N--CA 1.423 -1.789 0 CA-C-N 112.946 -1.934 . . . . 0.0 110.274 -176.534 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.546 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 51.6 mt-10 -72.65 -16.05 61.71 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.199 -2.149 . . . . 0.0 105.199 165.846 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 59.8 mttp . . . . . 0 CA--C 1.543 0.683 0 CA-C-N 113.444 -1.707 . . . . 0.0 109.942 174.088 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 84.0 mt . . . . . 0 N--CA 1.426 -1.649 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 12.9 m -60.75 176.65 0.37 Allowed 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -170.403 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -54.73 -17.63 3.69 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.684 1.993 . . . . 0.0 113.214 -175.655 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -53.07 -44.84 67.8 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 123.188 0.305 . . . . 0.0 110.986 177.236 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 470' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 38.1 tt0 -66.31 -30.76 71.24 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 119.511 -0.876 . . . . 0.0 111.046 -178.523 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 471' ' ' LYS . . . . . 0.462 ' HD3' HH21 ' A' ' 474' ' ' ARG . 27.8 tptp -64.62 -33.01 74.93 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.591 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -67.8 -44.86 76.37 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 473' ' ' GLU . . . . . 0.434 ' HB3' ' CE2' ' A' ' 504' ' ' PHE . 1.4 mp0 -56.64 -46.16 81.16 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.074 0.464 . . . . 0.0 110.529 172.837 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 37.7 mtm-85 -62.81 -37.7 87.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.384 -179.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 475' ' ' ALA . . . . . 0.654 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -72.13 -39.2 69.0 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 120.87 0.367 . . . . 0.0 110.927 176.831 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -63.56 -39.51 94.59 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-O 121.682 0.753 . . . . 0.0 110.797 -179.061 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 25.2 tp -71.78 -17.44 62.18 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.788 -1.096 . . . . 0.0 113.67 -173.904 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.654 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 19.5 pttp -70.78 -11.11 60.75 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -177.009 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -122.93 90.79 3.36 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.672 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.629 ' HA ' ' HB2' ' A' ' 483' ' ' ASP . 4.2 tt -143.02 71.22 1.33 Allowed 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.781 0.8 . . . . 0.0 109.266 177.666 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 65.0 mtt -97.15 -88.73 0.29 Allowed 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.561 177.392 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -72.31 -9.06 58.0 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.276 1.431 . . . . 0.0 109.616 174.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 483' ' ' ASP . . . . . 0.629 ' HB2' ' HA ' ' A' ' 480' ' ' LEU . 5.5 m-20 -69.18 37.48 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 128.411 2.685 . . . . 0.0 116.136 -166.355 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -53.41 -40.13 64.86 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 121.704 0.764 . . . . 0.0 109.983 172.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -60.0 -49.77 76.38 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.681 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 486' ' ' THR . . . . . 0.578 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 7.1 m -59.95 -42.18 93.47 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.101 0.96 . . . . 0.0 110.773 -178.866 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -54.79 -51.32 66.12 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 81.1 mt -68.68 -29.7 68.2 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.4 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -68.97 -34.26 75.02 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.778 0.323 . . . . 0.0 111.134 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -85.27 -40.14 16.93 Favored 'General case' 0 N--CA 1.419 -2.014 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -67.8 -35.15 78.13 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -77.48 -21.9 52.13 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 120.871 0.367 . . . . 0.0 110.525 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 64.5 m -83.8 -8.6 59.19 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.32 0.581 . . . . 0.0 111.76 -175.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 494' ' ' VAL . . . . . 0.427 HG22 ' OD1' ' A' ' 498' ' ' ASN . 0.3 OUTLIER -92.97 153.44 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.638 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -176.642 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -155.26 -105.69 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -172.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 496' ' ' LYS . . . . . 0.431 ' C ' ' H ' ' A' ' 498' ' ' ASN . 38.8 ttpt -90.3 -37.88 13.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.453 0.644 . . . . 0.0 110.533 178.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -75.28 30.84 0.1 Allowed 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 126.04 1.736 . . . . 0.0 112.322 -174.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 498' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 496' ' ' LYS . 6.0 m-20 -73.14 36.11 0.08 Allowed 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 126.779 2.032 . . . . 0.0 111.355 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -65.79 -13.06 58.72 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.258 -178.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 15.9 m -55.15 149.84 11.73 Favored 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 124.418 1.087 . . . . 0.0 108.743 173.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -65.58 155.23 36.42 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.615 -0.678 . . . . 0.0 112.032 -174.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -66.64 5.92 0.54 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.135 0.493 . . . . 0.0 111.894 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 503' ' ' HIS . . . . . 0.483 ' O ' HG23 ' A' ' 507' ' ' VAL . 1.5 m-70 -54.51 -51.78 64.04 Favored 'General case' 0 C--O 1.203 -1.353 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 172.925 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 504' ' ' PHE . . . . . 0.434 ' CE2' ' HB3' ' A' ' 473' ' ' GLU . 94.2 m-85 -65.15 -27.3 68.63 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.967 -1.015 . . . . 0.0 113.182 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -68.14 -44.23 76.5 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -38.5 89.13 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 119.787 -0.765 . . . . 0.0 109.677 177.806 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 507' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 503' ' ' HIS . 22.1 t -62.18 -47.11 94.66 Favored 'Isoleucine or valine' 0 C--N 1.354 0.778 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -47.78 -45.72 29.67 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.697 0.799 . . . . 0.0 111.235 173.685 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -60.05 -53.19 60.71 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.445 -179.253 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 18.5 t -58.87 -48.1 87.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 123.406 0.442 . . . . 0.0 109.945 178.225 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 511' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 97.1 mt -54.46 -56.53 17.78 Favored 'General case' 0 C--O 1.211 -0.971 0 O-C-N 124.067 0.854 . . . . 0.0 110.545 -178.231 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -60.3 -30.96 69.83 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 123.996 0.918 . . . . 0.0 110.774 -177.548 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.49 -46.66 66.09 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.597 -178.194 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . 0.251 11.2 p90 -82.83 -28.61 30.05 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 119.399 -0.92 . . . . 0.0 111.049 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -51.71 -35.67 43.9 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.802 1.241 . . . . 0.0 108.779 174.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -59.47 -28.83 67.35 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.036 -0.983 . . . . 0.0 111.234 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -103.36 -59.57 1.69 Allowed 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.485 179.222 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -157.38 122.18 4.43 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.279 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -90.87 96.95 10.89 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -174.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -142.27 124.23 15.29 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 161.583 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -67.97 129.24 39.31 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 119.45 1.023 . . . . 0.0 110.497 179.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -113.35 132.24 55.66 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.405 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 35.4 pt -78.47 -13.03 13.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.186 0 CA-C-O 121.17 0.51 . . . . 0.0 110.484 -177.75 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 524' ' ' SER . . . . . 0.555 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 33.1 t -58.17 -41.01 82.92 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.373 174.536 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -65.55 -35.86 82.08 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 108.901 -0.778 . . . . 0.0 108.901 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -60.71 -50.32 73.94 Favored 'General case' 0 C--O 1.213 -0.833 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.311 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 11.9 p -71.17 -18.02 20.27 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.868 -0.52 . . . . 0.0 111.006 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 528' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.4 mm100 -68.04 -39.78 83.0 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 170.947 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.52 ' CB ' ' HG3' ' A' ' 536' ' ' ARG . 8.1 m-85 -72.36 13.9 0.29 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.146 1.378 . . . . 0.0 112.894 176.596 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.758 ' HA ' ' NH2' ' A' ' 536' ' ' ARG . 8.7 p -72.74 18.4 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.592 2.585 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.453 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -129.16 -49.27 1.2 Allowed 'General case' 0 N--CA 1.479 0.991 0 O-C-N 120.953 -1.092 . . . . 0.0 109.714 176.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 27.4 t -76.04 -144.42 0.02 OUTLIER 'General case' 0 CA--C 1.578 2.036 0 C-N-CA 126.806 2.042 . . . . 0.0 112.349 -176.02 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 533' ' ' ASN . . . . . 0.481 ' C ' ' H ' ' A' ' 535' ' ' LEU . 2.0 t-20 -28.45 30.42 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.978 1 C-N-CA 138.831 6.853 . . . . 0.0 117.419 179.072 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -32.32 9.92 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.221 1 C-N-CA 131.762 4.025 . . . . 0.0 116.891 179.706 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.481 ' H ' ' C ' ' A' ' 533' ' ' ASN . 40.9 mt -63.51 -29.36 70.64 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 102.474 -3.158 . . . . 0.0 102.474 162.051 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.758 ' NH2' ' HA ' ' A' ' 530' ' ' VAL . 0.4 OUTLIER -54.27 -36.92 64.13 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 111.897 -2.411 . . . . 0.0 110.279 170.617 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -72.22 -37.24 69.24 Favored 'General case' 0 CA--C 1.483 -1.611 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -175.06 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 5.9 m -59.64 -40.98 89.44 Favored 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 118.837 -1.145 . . . . 0.0 108.965 170.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 63.8 tp -59.99 -34.51 73.42 Favored 'General case' 0 C--O 1.215 -0.734 0 O-C-N 121.619 -0.676 . . . . 0.0 111.676 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 53.0 mt -61.97 -35.12 66.49 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.261 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 5.5 p -58.3 -43.96 88.34 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 8.2 mp -64.78 -41.15 96.07 Favored 'General case' 0 N--CA 1.487 1.42 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.175 176.653 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -61.97 -35.42 78.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.173 0.989 . . . . 0.0 108.85 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 544' ' ' GLN . . . . . 0.494 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 53.4 tt0 -74.05 39.97 0.12 Allowed 'General case' 0 CA--C 1.567 1.606 0 CA-C-O 122.656 1.217 . . . . 0.0 111.209 177.066 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -75.05 157.08 35.41 Favored 'General case' 0 C--N 1.279 -2.47 0 O-C-N 120.949 -1.095 . . . . 0.0 111.086 177.122 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -102.73 -178.01 3.55 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.717 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.606 ' O ' ' HG3' ' A' ' 550' ' ' GLU . 92.2 mt -76.27 18.96 0.26 Allowed 'General case' 0 C--O 1.208 -1.111 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -173.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 548' ' ' ASN . . . . . 0.487 ' O ' ' HD2' ' A' ' 552' ' ' TYR . 31.3 p-10 -75.02 -8.5 56.71 Favored 'General case' 0 C--N 1.317 -0.836 0 O-C-N 121.934 -0.479 . . . . 0.0 110.974 179.587 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -70.15 0.86 5.45 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.927 0.891 . . . . 0.0 112.35 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.606 ' HG3' ' O ' ' A' ' 547' ' ' LEU . 45.8 mt-10 -55.08 133.35 68.29 Favored Pre-proline 0 C--O 1.239 0.544 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_exo 5.16 61.01 0.0 OUTLIER 'Trans proline' 0 C--N 1.376 1.994 1 C-N-CA 126.843 5.029 . . . . 0.0 115.878 -166.496 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 552' ' ' TYR . . . . . 0.62 ' O ' ' HG3' ' A' ' 555' ' ' GLU . 1.6 t80 -99.83 21.17 12.94 Favored 'General case' 0 C--O 1.205 -1.248 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 -175.186 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -68.35 11.1 0.18 Allowed 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -174.806 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 554' ' ' ASN . . . . . 0.55 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 6.9 t30 -75.18 -20.6 59.23 Favored 'General case' 0 C--O 1.17 -3.098 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 171.184 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 555' ' ' GLU . . . . . 0.62 ' HG3' ' O ' ' A' ' 552' ' ' TYR . 51.3 mt-10 -35.49 -46.04 0.37 Allowed 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 114.517 1.302 . . . . 0.0 114.517 -176.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 59.5 mt -58.78 -38.48 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 CA-C-N 118.28 0.491 . . . . 0.0 110.714 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 557' ' ' ASP . . . . . 0.55 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 3.4 t70 -59.54 -54.59 44.76 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.984 0.914 . . . . 0.0 108.808 176.781 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 558' ' ' ASP . . . . . 0.605 ' O ' HG23 ' A' ' 562' ' ' VAL . 12.8 m-20 -58.52 -53.92 52.83 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.006 177.71 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 559' ' ' TYR . . . . . 0.536 ' O ' HD13 ' A' ' 563' ' ' ILE . 63.3 t80 -51.86 -53.28 42.27 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 126.815 2.046 . . . . 0.0 111.881 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 49.3 t -59.84 -41.39 85.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 561' ' ' ASN . . . . . 0.624 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 8.0 t30 -60.89 -59.73 4.92 Favored 'General case' 0 C--O 1.193 -1.906 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.558 175.227 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 562' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 558' ' ' ASP . 60.1 t -55.07 -36.98 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 C-N-CA 124.074 0.949 . . . . 0.0 112.714 -172.753 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.536 HD13 ' O ' ' A' ' 559' ' ' TYR . 1.6 mp -80.15 -40.61 20.35 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.544 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.917 -172.419 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -95.45 7.09 47.25 Favored 'General case' 0 N--CA 1.416 -2.167 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.869 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.624 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 52.5 mt-10 -71.67 -23.68 61.71 Favored 'General case' 0 C--N 1.368 1.391 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 170.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 62.5 tttm . . . . . 0 CA--C 1.557 1.224 0 CA-C-N 113.902 -1.499 . . . . 0.0 114.324 -176.453 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 92.2 mt . . . . . 0 N--CA 1.432 -1.332 0 CA-C-O 121.36 0.6 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 39.7 m -101.76 127.86 48.35 Favored 'General case' 0 C--N 1.278 -2.502 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 468' ' ' ARG . . . . . 0.524 ' HB2' HG13 ' A' ' 562' ' ' VAL . 88.4 mtm180 -62.74 -12.77 26.11 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -177.77 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 469' ' ' GLN . . . . . 0.461 ' O ' ' HG3' ' A' ' 473' ' ' GLU . 24.6 mt-30 -40.99 -49.55 3.29 Favored 'General case' 0 C--O 1.206 -1.185 0 C-N-CA 125.479 1.511 . . . . 0.0 114.156 -177.789 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -68.74 -31.81 71.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.953 0.406 . . . . 0.0 111.039 -174.803 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 22.8 tptp -74.76 -29.81 61.26 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 472' ' ' ALA . . . . . 0.537 ' HB2' HG11 ' A' ' 562' ' ' VAL . . . -69.82 -47.92 60.97 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 174.417 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 473' ' ' GLU . . . . . 0.483 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 57.7 mt-10 -49.81 -49.57 48.32 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.64 0.776 . . . . 0.0 109.488 173.687 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 474' ' ' ARG . . . . . 0.55 ' HG3' ' CD2' ' A' ' 542' ' ' LEU . 11.1 tpp85 -46.79 -60.89 2.12 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 125.261 1.424 . . . . 0.0 109.657 -178.277 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 475' ' ' ALA . . . . . 0.533 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -68.53 -36.01 78.26 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-N 115.289 -0.868 . . . . 0.0 112.445 -177.132 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -33.54 74.69 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.332 0.586 . . . . 0.0 112.079 -177.218 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 477' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 94.0 mt -73.47 -8.84 57.57 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -176.775 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 478' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 63.3 pttt -76.5 6.38 5.86 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.917 -0.49 . . . . 0.0 110.993 -178.133 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 10.4 t-80 -77.75 23.94 0.23 Allowed 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 123.741 0.816 . . . . 0.0 112.729 -172.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 480' ' ' LEU . . . . . 0.4 HD12 ' H ' ' A' ' 482' ' ' ARG 0.29 2.7 pp 49.76 -158.8 0.07 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.629 1.572 . . . . 0.0 114.798 177.165 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 481' ' ' MET . . . . . 0.469 ' C ' ' H ' ' A' ' 483' ' ' ASP . 46.9 ttm -66.7 6.95 0.41 Allowed 'General case' 0 CA--C 1.569 1.695 0 CA-C-O 122.569 1.175 . . . . 0.0 113.648 -174.659 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 482' ' ' ARG . . . . . 0.4 ' H ' HD12 ' A' ' 480' ' ' LEU . 26.7 mmt180 -74.69 11.1 1.12 Allowed 'General case' 0 C--O 1.248 0.998 0 C-N-CA 123.899 0.88 . . . . 0.0 110.153 167.102 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 483' ' ' ASP . . . . . 0.469 ' H ' ' C ' ' A' ' 481' ' ' MET . 9.5 p-10 -68.81 1.0 3.65 Favored 'General case' 0 C--O 1.201 -1.478 0 C-N-CA 126.231 1.812 . . . . 0.0 113.608 -169.304 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -72.28 -60.37 2.26 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.54 -53.52 56.59 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.544 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 86.1 m -59.44 -37.97 79.49 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.786 -178.716 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 487' ' ' PHE . . . . . 0.415 ' HB2' ' O ' ' A' ' 483' ' ' ASP . 46.7 t80 -56.15 -58.02 9.73 Favored 'General case' 0 C--O 1.205 -1.269 0 C-N-CA 120.419 -0.513 . . . . 0.0 110.158 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 5.9 mp -72.29 -31.91 66.13 Favored 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 119.454 -0.898 . . . . 0.0 111.364 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -68.26 -41.06 81.67 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.932 0.396 . . . . 0.0 111.32 -177.196 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -85.28 -35.41 21.53 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.546 -178.685 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -58.26 -46.36 86.15 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 122.873 0.469 . . . . 0.0 112.259 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -81.65 -15.58 54.12 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -177.118 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 73.4 m -80.98 -28.42 35.56 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -178.293 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 11.8 t -98.52 152.3 4.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -152.23 -39.58 0.11 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.693 0.759 . . . . 0.0 110.27 -178.134 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -82.44 18.7 1.4 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.938 178.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 497' ' ' ASP . . . . . 0.742 ' O ' ' HB3' ' A' ' 501' ' ' ASN . 7.6 p-10 -65.93 -19.51 65.89 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 123.837 0.855 . . . . 0.0 110.78 -178.99 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 498' ' ' ASN . . . . . 0.437 ' HA ' ' ND2' ' A' ' 501' ' ' ASN . 6.9 t-20 -72.88 15.45 0.2 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.751 1.22 . . . . 0.0 114.023 -165.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -75.65 -71.95 0.34 Allowed 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 26.0 m -127.36 93.36 3.71 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 170.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 501' ' ' ASN . . . . . 0.742 ' HB3' ' O ' ' A' ' 497' ' ' ASP . 34.8 p-10 -127.14 46.33 2.54 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -169.127 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 18.3 pm0 -73.17 -25.29 60.74 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.319 -0.952 . . . . 0.0 108.485 173.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 503' ' ' HIS . . . . . 0.436 ' O ' HG23 ' A' ' 507' ' ' VAL . 38.3 t-80 -62.64 -64.49 0.9 Allowed 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.218 175.888 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -55.74 -38.48 69.85 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 124.025 0.93 . . . . 0.0 110.639 -179.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -64.88 -52.02 58.82 Favored 'General case' 0 CA--C 1.5 -0.943 0 C-N-CA 123.079 0.552 . . . . 0.0 109.595 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -62.61 -41.67 99.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 507' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 503' ' ' HIS . 67.0 t -62.36 -52.96 53.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.714 178.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -49.64 -53.06 26.41 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 124.534 1.146 . . . . 0.0 111.838 176.031 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -56.79 -62.63 1.6 Allowed 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.321 0.648 . . . . 0.0 112.185 -177.312 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 48.6 t -59.69 -45.85 93.98 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.665 0 O-C-N 123.692 0.62 . . . . 0.0 110.944 -176.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 3.2 tt -69.23 -49.08 59.66 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.955 -172.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -67.76 -29.52 68.75 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.185 -176.228 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -64.43 -49.23 72.33 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.244 0.545 . . . . 0.0 110.434 178.707 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -70.48 -55.25 9.4 Favored 'General case' 0 C--O 1.198 -1.627 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.232 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -52.67 -36.32 56.74 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -178.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -77.6 -19.38 55.67 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.34 -45.6 2.92 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 122.111 0.958 . . . . 0.0 110.018 -172.792 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 39.0 t-20 -112.38 -154.34 0.54 Allowed 'General case' 0 C--N 1.286 -2.169 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 519' ' ' ASP . . . . . 0.406 ' HB3' ' H ' ' A' ' 520' ' ' GLN . 9.1 m-20 -83.82 -160.24 0.43 Allowed 'General case' 0 C--N 1.308 -1.221 0 C-N-CA 123.468 0.707 . . . . 0.0 109.878 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 520' ' ' GLN . . . . . 0.425 ' HB3' ' OD1' ' A' ' 483' ' ' ASP . 15.5 mp0 -62.62 177.12 0.56 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.617 0.767 . . . . 0.0 110.257 178.265 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -88.11 148.81 24.27 Favored 'General case' 1 N--CA 1.37 -4.449 0 O-C-N 121.543 -0.723 . . . . 0.0 109.638 -175.242 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 522' ' ' ASN . . . . . 0.493 ' HB3' ' OD2' ' A' ' 525' ' ' ASP . 52.0 t30 -116.11 154.64 29.6 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.466 0.65 . . . . 0.0 111.313 -174.634 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -37.21 78.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 C-N-CA 124.776 1.23 . . . . 0.0 110.7 -178.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 39.0 t -57.1 -33.01 66.88 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.956 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 525' ' ' ASP . . . . . 0.493 ' OD2' ' HB3' ' A' ' 522' ' ' ASN . 12.0 m-20 -61.1 -40.69 94.7 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.303 0.573 . . . . 0.0 110.0 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 526' ' ' ALA . . . . . 0.47 ' HA ' ' HD3' ' A' ' 536' ' ' ARG . . . -63.57 -43.17 97.79 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.243 178.019 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 527' ' ' VAL . . . . . 0.495 ' O ' HG22 ' A' ' 530' ' ' VAL . 96.9 t -64.63 -35.34 74.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 C-N-CA 125.033 1.333 . . . . 0.0 110.805 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -66.74 -34.63 78.26 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.43 0.634 . . . . 0.0 109.595 175.4 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.605 ' HB3' ' HD2' ' A' ' 536' ' ' ARG . 1.1 t80 -77.28 2.62 15.11 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 -178.735 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 530' ' ' VAL . . . . . 0.495 HG22 ' O ' ' A' ' 527' ' ' VAL . 14.7 m -74.69 15.0 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -176.174 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -109.03 -36.22 6.13 Favored 'General case' 0 C--N 1.285 -2.228 0 C-N-CA 119.458 -0.897 . . . . 0.0 108.644 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 532' ' ' SER . . . . . 0.495 ' C ' ' H ' ' A' ' 534' ' ' GLU . 26.3 t -81.44 -143.16 0.05 OUTLIER 'General case' 0 C--N 1.29 -2.019 0 C-N-CA 125.63 1.572 . . . . 0.0 107.673 173.234 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 533' ' ' ASN . . . . . 0.463 ' C ' ' H ' ' A' ' 535' ' ' LEU 0.386 17.2 m120 -35.14 29.08 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.986 1 C-N-CA 132.926 4.49 . . . . 0.0 118.764 171.607 . . . . . . . . 4 3 . 1 . 020 nuclear build core ' A' A ' 534' ' ' GLU . . . . . 0.495 ' H ' ' C ' ' A' ' 532' ' ' SER . 9.6 pt-20 -34.63 8.04 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 130.515 3.526 . . . . 0.0 116.008 177.656 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 535' ' ' LEU . . . . . 0.463 ' H ' ' C ' ' A' ' 533' ' ' ASN . 3.3 pp -67.77 -21.36 65.26 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 162.179 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 536' ' ' ARG . . . . . 0.605 ' HD2' ' HB3' ' A' ' 529' ' ' TYR . 28.0 ttm-85 -66.56 -24.86 66.42 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.676 -1.602 . . . . 0.0 110.445 171.191 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 537' ' ' GLU . . . . . 0.45 ' HA ' HD12 ' A' ' 540' ' ' ILE . 2.4 tm-20 -75.34 -39.2 59.63 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.803 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 538' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 541' ' ' SER . 8.9 m -57.7 -42.23 83.29 Favored 'General case' 0 CA--C 1.563 1.48 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.45 173.61 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.07 -43.09 91.71 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.031 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 540' ' ' ILE . . . . . 0.566 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 75.2 mt -57.29 -40.51 74.35 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.256 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 541' ' ' SER . . . . . 0.414 ' HB2' ' O ' ' A' ' 538' ' ' THR . 26.4 m -56.31 -38.79 71.75 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 120.934 0.397 . . . . 0.0 111.339 177.785 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 542' ' ' LEU . . . . . 0.615 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 8.3 mp -69.59 -24.8 63.73 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 120.801 0.334 . . . . 0.0 111.644 174.393 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -75.44 -38.64 59.6 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 544' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 540' ' ' ILE . 74.7 mm-40 -79.5 33.63 0.25 Allowed 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 125.763 1.625 . . . . 0.0 110.481 177.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 545' ' ' TYR . . . . . 0.615 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 8.6 p90 -65.12 154.49 37.76 Favored 'General case' 0 N--CA 1.404 -2.77 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -169.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -83.6 -176.19 6.18 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.497 -1.228 . . . . 0.0 109.017 -174.342 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 547' ' ' LEU . . . . . 0.421 ' C ' ' H ' ' A' ' 549' ' ' ASP . 2.2 pp -69.45 17.54 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -174.927 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -73.96 22.43 0.09 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.251 1.821 . . . . 0.0 111.782 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 549' ' ' ASP . . . . . 0.421 ' H ' ' C ' ' A' ' 547' ' ' LEU . 28.5 t70 -72.12 -6.79 45.05 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 124.008 0.923 . . . . 0.0 112.19 -177.588 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 550' ' ' GLU . . . . . 0.409 ' HB2' ' HD2' ' A' ' 551' ' ' PRO . 1.0 OUTLIER -59.43 158.91 18.6 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-O 119.313 -0.375 . . . . 0.0 110.266 -177.629 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 551' ' ' PRO . . . . . 0.409 ' HD2' ' HB2' ' A' ' 550' ' ' GLU . 20.0 Cg_endo -59.7 72.99 0.06 OUTLIER 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 122.86 2.373 . . . . 0.0 115.105 -179.088 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -100.67 9.7 42.11 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 173.658 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.35 14.2 0.1 Allowed 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 113.408 -1.724 . . . . 0.0 113.934 -174.47 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 554' ' ' ASN . . . . . 0.546 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 3.9 t30 -68.5 -19.98 64.56 Favored 'General case' 0 C--O 1.192 -1.953 0 N-CA-C 104.12 -2.548 . . . . 0.0 104.12 165.729 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -33.46 -42.06 0.09 Allowed 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 127.528 2.331 . . . . 0.0 111.783 168.587 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 21.9 mm -62.02 -44.3 98.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 109.425 -0.584 . . . . 0.0 109.425 177.468 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 557' ' ' ASP . . . . . 0.546 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 6.4 t70 -58.64 -44.11 89.96 Favored 'General case' 0 C--O 1.25 1.112 0 C-N-CA 124.261 1.024 . . . . 0.0 110.443 176.625 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -68.91 -49.21 60.08 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.325 177.309 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 559' ' ' TYR . . . . . 0.471 ' CD1' ' HB1' ' A' ' 472' ' ' ALA . 48.4 t80 -50.25 -52.06 39.38 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.164 1.386 . . . . 0.0 111.356 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 48.4 t -62.96 -39.18 84.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.213 -179.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -61.45 -36.5 80.58 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-O 120.705 0.288 . . . . 0.0 110.514 175.046 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 562' ' ' VAL . . . . . 0.537 HG11 ' HB2' ' A' ' 472' ' ' ALA . 54.0 t -70.63 -33.75 54.3 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.05 0 C-N-CA 123.863 0.865 . . . . 0.0 112.905 177.692 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 563' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 559' ' ' TYR . 49.1 mm -84.17 -40.1 15.25 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.717 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 -176.965 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -79.39 -2.97 44.17 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 114.449 -1.25 . . . . 0.0 110.164 178.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 565' ' ' GLU . . . . . 0.522 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 19.1 tt0 -56.55 -35.08 67.73 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 170.201 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 19.9 mmtp . . . . . 0 N--CA 1.439 -1.013 0 CA-C-N 113.927 -1.488 . . . . 0.0 109.885 179.065 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 . . . . . 0 C--O 1.251 1.14 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -92.15 101.66 14.18 Favored 'General case' 0 N--CA 1.418 -2.032 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 173.49 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -114.15 56.6 0.71 Allowed 'General case' 0 C--N 1.292 -1.928 0 C-N-CA 119.943 -0.703 . . . . 0.0 109.48 -174.662 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 89.0 mt -66.6 98.08 0.49 Allowed 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 170.54 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 467' ' ' SER . . . . . 0.446 ' HB3' ' OE1' ' A' ' 470' ' ' GLU . 33.0 t -85.46 174.66 9.34 Favored 'General case' 0 C--N 1.272 -2.795 0 CA-C-N 114.461 -1.245 . . . . 0.0 111.889 -171.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 10.0 ptm85 -65.5 -22.86 66.77 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.611 -1.631 . . . . 0.0 110.744 176.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.496 HE21 HG23 ' A' ' 563' ' ' ILE . 51.0 mt-30 -67.27 -34.35 77.24 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 177.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.446 ' OE1' ' HB3' ' A' ' 467' ' ' SER . 2.3 mp0 -73.86 -23.2 59.58 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.509 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.02 -33.38 70.3 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 106.168 -1.79 . . . . 0.0 106.168 174.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 472' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 469' ' ' GLN . . . -67.25 -42.29 84.16 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.492 174.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.7 -60.62 2.96 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 122.37 1.081 . . . . 0.0 109.257 172.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 55.2 mtt180 -52.83 -46.34 67.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 113.66 -1.609 . . . . 0.0 112.466 -178.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -70.89 -36.82 72.92 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -62.95 -29.84 71.11 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 121.577 0.703 . . . . 0.0 110.57 -178.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 91.5 mt -73.23 -7.33 51.0 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.968 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 542' ' ' LEU . 37.8 ttmt -77.17 -13.67 59.91 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 176.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 54.8 t60 -60.66 137.74 58.15 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 63.2 mt -51.52 123.35 9.67 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-O 122.126 0.965 . . . . 0.0 112.573 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 52.4 mtt -71.74 1.26 7.12 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.286 -1.779 . . . . 0.0 113.502 -170.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -68.08 -44.65 75.82 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 171.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -74.7 58.78 0.82 Allowed 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 126.485 1.914 . . . . 0.0 111.879 -174.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' LYS . . . . . 0.634 ' HE3' HD23 ' A' ' 511' ' ' LEU . 12.5 mmmm -62.14 -18.01 59.59 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.965 -1.016 . . . . 0.0 113.346 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -57.46 -39.85 77.23 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 171.805 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 19.8 m -60.17 -35.01 74.39 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.843 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 487' ' ' PHE . . . . . 0.465 ' CE1' ' HA ' ' A' ' 508' ' ' PHE . 4.9 t80 -58.62 -51.98 67.61 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-O 121.122 0.487 . . . . 0.0 110.078 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 53.9 tp -70.57 -31.48 68.53 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.809 -176.518 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -69.5 -42.11 75.2 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.007 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.66 -31.43 57.31 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -178.208 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 491' ' ' TYR . . . . . 0.41 ' O ' HG12 ' A' ' 494' ' ' VAL . 6.3 t80 -60.39 -51.1 70.91 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.45 176.43 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -85.29 -12.11 53.14 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 45.8 m -87.41 -15.16 38.57 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.634 0.731 . . . . 0.0 109.527 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 494' ' ' VAL . . . . . 0.41 HG12 ' O ' ' A' ' 491' ' ' TYR . 1.4 p -99.45 176.52 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.415 -2.216 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.01 -175.678 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -85.01 100.71 11.85 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.469 0.652 . . . . 0.0 111.811 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -65.5 -30.46 71.23 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.486 178.708 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.8 -72.04 0.21 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.67 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -92.12 -33.43 14.76 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -78.64 -7.59 57.79 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.956 -171.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.3 t -60.73 108.33 0.83 Allowed 'General case' 0 CA--C 1.563 1.445 0 CA-C-O 123.299 1.523 . . . . 0.0 111.235 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.425 ' ND2' ' HG2' ' A' ' 470' ' ' GLU . 54.2 t-20 -93.94 157.65 16.01 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 113.56 -1.655 . . . . 0.0 107.679 -178.005 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -62.84 -34.04 76.51 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 122.032 0.92 . . . . 0.0 108.821 174.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -60.18 -51.02 71.35 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.683 -1.144 . . . . 0.0 108.76 174.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -60.7 -37.64 82.35 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.859 178.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -63.65 -51.69 64.07 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 506' ' ' TYR . . . . . . . . . . . . 0.256 25.8 m-85 -62.84 -42.3 99.68 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 177.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 507' ' ' VAL . . . . . 0.492 ' O ' HD13 ' A' ' 511' ' ' LEU . 92.5 t -63.51 -56.7 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.945 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 508' ' ' PHE . . . . . 0.465 ' HA ' ' CE1' ' A' ' 487' ' ' PHE . 13.6 t80 -49.27 -48.65 45.81 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 177.289 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -61.73 -55.9 25.35 Favored 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 123.185 0.594 . . . . 0.0 111.821 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 42.9 t -61.62 -45.71 98.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.688 0.756 . . . . 0.0 110.717 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.634 HD23 ' HE3' ' A' ' 484' ' ' LYS . 10.3 mp -67.67 -31.57 71.63 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.406 -175.612 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 13.9 t60 -72.31 -32.86 66.92 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.013 176.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.0 -40.81 98.89 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.371 0.605 . . . . 0.0 110.231 -179.28 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -76.3 -36.64 58.26 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.949 176.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 515' ' ' TYR . . . . . 0.6 ' HA ' ' HB2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -53.25 -34.04 55.56 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.269 1.027 . . . . 0.0 110.223 177.595 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.59 -18.85 62.2 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.281 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -134.13 -57.76 0.85 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 117.686 -1.606 . . . . 0.0 113.772 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -152.03 107.02 3.25 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 106.028 -1.841 . . . . 0.0 106.028 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 519' ' ' ASP . . . . . 0.6 ' HB2' ' HA ' ' A' ' 515' ' ' TYR . 28.8 t0 -107.56 96.16 6.2 Favored 'General case' 0 C--N 1.284 -2.267 0 N-CA-C 117.718 2.488 . . . . 0.0 117.718 -163.161 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -141.96 126.3 17.63 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 113.984 -1.462 . . . . 0.0 107.722 162.058 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -100.63 132.9 45.78 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -120.19 172.3 7.88 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 523' ' ' ILE . . . . . 0.523 HG13 HD12 ' A' ' 540' ' ' ILE . 0.9 OUTLIER -52.05 -46.29 42.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 C-N-CA 126.803 2.041 . . . . 0.0 109.877 171.299 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.408 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 2.9 m -51.75 -37.22 50.23 Favored 'General case' 0 N--CA 1.428 -1.533 0 C-N-CA 125.508 1.523 . . . . 0.0 111.627 -176.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -65.23 -50.8 64.46 Favored 'General case' 0 C--O 1.248 0.992 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.799 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.536 ' HB3' HD11 ' A' ' 540' ' ' ILE . . . -65.98 -28.95 69.28 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.384 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.527 ' HA ' HG13 ' A' ' 530' ' ' VAL . 42.7 t -67.97 -35.36 71.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 C-N-CA 125.321 1.448 . . . . 0.0 110.997 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 528' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 524' ' ' SER . 98.8 mt-30 -65.9 -30.5 71.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 174.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.549 ' HB3' ' HG2' ' A' ' 536' ' ' ARG . 31.5 m-85 -76.5 9.42 2.71 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 175.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.617 ' HA ' ' CZ ' ' A' ' 536' ' ' ARG . 34.4 m -72.7 12.49 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.637 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 -176.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -108.46 -43.66 4.27 Favored 'General case' 0 C--N 1.276 -2.597 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 170.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 6.5 m -75.51 -144.07 0.02 OUTLIER 'General case' 0 C--N 1.289 -2.05 0 C-N-CA 127.73 2.412 . . . . 0.0 112.512 -178.606 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 533' ' ' ASN . . . . . 0.461 ' O ' ' N ' ' A' ' 535' ' ' LEU . 16.8 m120 -26.64 30.94 0.0 OUTLIER 'General case' 0 CA--C 1.469 -2.14 1 C-N-CA 138.99 6.916 . . . . 0.0 118.402 179.017 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 534' ' ' GLU . . . . . 0.534 ' HA ' ' NE ' ' A' ' 536' ' ' ARG . 9.0 pt-20 -30.07 -5.91 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.752 0 C-N-CA 130.769 3.628 . . . . 0.0 116.904 -175.127 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.57 HD13 ' H ' ' A' ' 535' ' ' LEU . 0.0 OUTLIER -68.55 -12.18 60.94 Favored 'General case' 0 CA--C 1.57 1.745 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 163.86 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.627 ' HD2' ' N ' ' A' ' 537' ' ' GLU . 3.8 ppt_? -66.8 -28.76 68.64 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 126.65 1.98 . . . . 0.0 109.9 169.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 537' ' ' GLU . . . . . 0.627 ' N ' ' HD2' ' A' ' 536' ' ' ARG . 43.3 tt0 -77.05 -41.0 44.2 Favored 'General case' 0 CA--C 1.479 -1.77 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' A' ' 541' ' ' SER . 18.5 m -56.3 -47.73 78.09 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.254 173.194 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 55.7 tp -57.59 -45.65 85.02 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 122.825 0.45 . . . . 0.0 111.526 176.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 540' ' ' ILE . . . . . 0.536 HD11 ' HB3' ' A' ' 526' ' ' ALA . 24.8 mm -61.25 -40.45 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 176.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 541' ' ' SER . . . . . 0.431 ' HB3' ' O ' ' A' ' 538' ' ' THR . 35.9 t -57.24 -41.59 79.85 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 123.543 0.737 . . . . 0.0 110.033 174.461 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.405 ' O ' ' HE2' ' A' ' 478' ' ' LYS . 3.8 mm? -63.09 -37.72 88.32 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.164 174.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -68.7 -32.49 72.34 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-O 121.542 0.687 . . . . 0.0 110.441 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.5 tp60 -67.54 -34.95 78.13 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.122 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -70.61 136.41 49.15 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.68 172.117 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -102.75 141.72 35.08 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -169.284 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 87.1 mt -82.55 4.4 24.7 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.068 -1.424 . . . . 0.0 109.193 171.666 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -73.08 -58.07 3.58 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.955 -1.02 . . . . 0.0 108.71 174.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -74.65 -6.06 46.58 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.226 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -109.22 139.5 21.09 Favored Pre-proline 0 C--N 1.306 -1.287 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.611 177.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 16.3 Cg_exo -71.3 152.36 61.14 Favored 'Trans proline' 0 C--O 1.242 0.718 0 N-CA-C 107.166 -1.898 . . . . 0.0 107.166 168.115 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -76.32 -2.49 31.9 Favored 'General case' 0 CA--C 1.503 -0.833 0 C-N-CA 118.669 -1.212 . . . . 0.0 112.794 -176.215 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 553' ' ' GLU . . . . . 0.69 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 44.2 mp0 -74.96 -13.48 60.52 Favored 'General case' 0 C--N 1.278 -2.505 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.032 173.924 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -69.31 -21.56 63.85 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.458 172.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -78.98 -92.74 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.552 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 28.5 pt -58.89 -45.5 91.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -174.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 557' ' ' ASP . . . . . 0.69 ' HB3' ' O ' ' A' ' 553' ' ' GLU . 3.4 t70 -60.27 -60.75 3.32 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 117.783 0.265 . . . . 0.0 110.509 -178.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.02 -41.77 98.45 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.976 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -54.69 -52.77 61.36 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 124.251 1.02 . . . . 0.0 111.026 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.07 -46.67 90.62 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.518 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -55.33 -46.42 76.36 Favored 'General case' 0 C--O 1.204 -1.296 0 C-N-CA 123.494 0.717 . . . . 0.0 112.503 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 562' ' ' VAL . . . . . 0.543 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 53.1 t -66.62 -40.42 86.2 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.123 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.496 HG23 HE21 ' A' ' 469' ' ' GLN . 54.1 mt -83.37 -32.78 9.44 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.298 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.75 -174.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -89.88 -8.24 52.35 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.941 -176.563 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 12.4 pt-20 -76.72 -20.06 56.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 177.442 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -77.98 53.52 1.19 Allowed 'General case' 0 CA--C 1.562 1.416 0 CA-C-N 113.988 -1.46 . . . . 0.0 109.062 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -134.88 -127.55 2.72 Favored Glycine 0 N--CA 1.404 -3.434 0 N-CA-C 108.18 -1.968 . . . . 0.0 108.18 175.403 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -111.16 13.72 21.82 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -71.63 116.24 11.75 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 113.887 -1.506 . . . . 0.0 111.581 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 570' ' ' THR . . . . . 0.645 ' HB ' ' OE2' ' A' ' 572' ' ' GLU . 1.3 m -97.41 -179.21 4.41 Favored 'General case' 0 N--CA 1.422 -1.83 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 178.392 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 9.5 pt -43.57 -44.35 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -178.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 572' ' ' GLU . . . . . 0.697 ' OE1' ' HD2' ' A' ' 604' ' ' ARG . 0.0 OUTLIER -83.6 -28.35 28.56 Favored 'General case' 0 C--O 1.172 -2.979 0 C-N-CA 119.755 -0.778 . . . . 0.0 112.926 -179.142 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 573' ' ' SER . . . . . 0.411 ' HA ' ' ND2' ' A' ' 601' ' ' ASN . 17.4 m -65.99 -22.33 66.46 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-O 122.482 1.134 . . . . 0.0 109.558 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 570' ' ' THR . 56.4 mt -60.38 -30.93 69.89 Favored 'General case' 0 N--CA 1.421 -1.881 0 CA-C-N 113.846 -1.524 . . . . 0.0 108.422 173.272 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 575' ' ' ASN . . . . . 0.671 ' HB3' HG22 ' A' ' 598' ' ' VAL . 9.4 m120 -60.13 -47.01 87.7 Favored 'General case' 0 CA--C 1.5 -0.944 0 C-N-CA 123.743 0.817 . . . . 0.0 109.319 177.396 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 576' ' ' HIS . . . . . 0.464 ' HB2' ' OD1' ' A' ' 601' ' ' ASN . 16.8 t60 -56.14 -53.77 53.13 Favored 'General case' 0 CA--C 1.495 -1.14 0 O-C-N 124.118 0.886 . . . . 0.0 110.071 -178.498 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -69.48 -35.16 75.32 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 119.572 -0.851 . . . . 0.0 113.015 -175.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 2.5 tt -61.17 -52.15 66.05 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.504 ' HB2' HG21 ' A' ' 598' ' ' VAL . 26.2 tpt85 -61.36 -38.19 86.07 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.404 178.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -68.65 -46.21 69.78 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.024 -178.227 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -59.97 -45.15 93.6 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 121.291 0.567 . . . . 0.0 111.932 177.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.447 HG21 ' HE2' ' A' ' 591' ' ' LYS . 21.0 p -68.67 -25.91 65.04 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.536 0.734 . . . . 0.0 112.715 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.402 ' HA ' ' OE1' ' A' ' 588' ' ' GLU . 73.6 ttt180 -53.67 1.86 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 126.713 2.005 . . . . 0.0 114.326 -178.649 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 7.0 tp -80.05 -10.8 12.67 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 CA-C-O 122.053 0.93 . . . . 0.0 110.864 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 128.39 50.29 0.14 Allowed Glycine 0 C--N 1.298 -1.554 0 CA-C-O 122.14 0.856 . . . . 0.0 111.597 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 586' ' ' ASP . . . . . 0.562 ' C ' ' H ' ' A' ' 588' ' ' GLU . 38.9 t70 -95.27 169.24 10.22 Favored 'General case' 0 C--N 1.293 -1.86 0 C-N-CA 126.321 1.849 . . . . 0.0 109.658 179.196 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 29.4 m -46.62 23.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.586 2.338 0 C-N-CA 128.46 2.704 . . . . 0.0 114.914 170.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.562 ' H ' ' C ' ' A' ' 586' ' ' ASP . 37.3 mt-10 -43.11 -2.63 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 130.863 3.665 . . . . 0.0 116.207 -174.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 62.1 tp -72.65 -54.02 10.19 Favored 'General case' 0 C--O 1.266 1.938 0 N-CA-C 105.569 -2.011 . . . . 0.0 105.569 166.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -53.37 -52.66 58.56 Favored 'General case' 0 CA--C 1.5 -0.957 0 CA-C-N 113.875 -1.511 . . . . 0.0 107.619 170.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.486 ' HB2' ' HA ' ' A' ' 588' ' ' GLU 0.39 62.1 mttp -73.78 -9.72 58.95 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 -177.749 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -67.49 -41.16 84.98 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 169.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -61.2 -43.03 99.53 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.154 173.218 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.447 ' O ' ' HB ' ' A' ' 597' ' ' ILE . 38.6 tp -59.24 -36.96 76.41 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 175.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.53 ' HA ' ' CG2' ' A' ' 598' ' ' VAL . 45.6 tt0 -67.64 -19.19 65.18 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.922 178.528 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 596' ' ' GLN . . . . . 0.458 ' O ' ' HB3' ' A' ' 599' ' ' ALA . 86.5 mm-40 -68.8 -42.73 76.91 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 168.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.447 ' HB ' ' O ' ' A' ' 594' ' ' LEU . 2.1 mp -59.51 -40.8 82.83 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.016 0 CA-C-O 121.887 0.851 . . . . 0.0 109.32 171.439 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 598' ' ' VAL . . . . . 0.671 HG22 ' HB3' ' A' ' 575' ' ' ASN . 58.7 t -63.13 -29.39 47.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.954 174.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.572 ' HA ' ' HE3' ' A' ' 602' ' ' LYS . . . -62.63 -39.57 94.24 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.986 178.008 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 600' ' ' LYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 597' ' ' ILE . 5.1 ttpm? -60.35 -41.41 93.59 Favored 'General case' 0 C--O 1.256 1.437 0 CA-C-O 121.721 0.772 . . . . 0.0 109.351 174.9 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 601' ' ' ASN . . . . . 0.516 ' HB3' ' O ' ' A' ' 598' ' ' VAL . 1.8 t-20 -56.83 -54.23 48.8 Favored 'General case' 0 C--O 1.201 -1.472 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.099 177.848 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.572 ' HE3' ' HA ' ' A' ' 599' ' ' ALA . 0.0 OUTLIER -73.24 -16.76 61.39 Favored 'General case' 0 C--N 1.273 -2.761 0 C-N-CA 120.064 -0.654 . . . . 0.0 112.247 -179.247 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -79.19 -8.62 59.15 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 171.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 604' ' ' ARG . . . . . 0.697 ' HD2' ' OE1' ' A' ' 572' ' ' GLU . 15.3 ptm180 -58.13 -22.74 52.26 Favored 'General case' 0 N--CA 1.503 2.221 0 CA-C-O 121.248 0.547 . . . . 0.0 111.391 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 20.5 ptm . . . . . 0 N--CA 1.425 -1.693 0 CA-C-O 118.799 -0.619 . . . . 0.0 110.072 -179.57 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 N--CA 1.449 -0.524 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -96.93 138.73 34.02 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 120.999 0.428 . . . . 0.0 110.907 177.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -136.72 111.05 8.45 Favored 'General case' 0 N--CA 1.402 -2.853 0 N-CA-C 101.44 -3.541 . . . . 0.0 101.44 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.5 pp -49.23 161.3 0.18 Allowed 'General case' 0 C--N 1.267 -3.009 0 N-CA-C 116.137 1.903 . . . . 0.0 116.137 -173.408 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 467' ' ' SER . . . . . 0.441 ' O ' ' HG2' ' A' ' 470' ' ' GLU . 28.8 m -89.14 137.13 32.6 Favored 'General case' 0 N--CA 1.42 -1.959 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.711 -178.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 468' ' ' ARG . . . . . 0.478 HH21 ' CD ' ' A' ' 565' ' ' GLU . 20.1 ptt180 -60.09 -23.06 63.5 Favored 'General case' 0 C--O 1.26 1.643 0 CA-C-O 122.103 0.954 . . . . 0.0 111.001 176.51 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.456 ' OE1' ' HD2' ' A' ' 566' ' ' LYS . 0.0 OUTLIER -57.03 -38.17 72.78 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.837 177.361 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.635 ' O ' ' HG2' ' A' ' 474' ' ' ARG . 9.1 pt-20 -71.22 -21.9 62.07 Favored 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 119.281 -0.968 . . . . 0.0 111.699 -174.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -73.1 -39.99 65.35 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -60.75 -40.45 92.5 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.091 175.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 473' ' ' GLU . . . . . 0.429 ' HG2' ' HA ' ' A' ' 470' ' ' GLU . 49.0 mm-40 -61.16 -35.71 77.86 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.79 176.529 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.635 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 21.0 mmt85 -58.63 -42.26 87.87 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -71.46 -47.42 55.82 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.581 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -58.43 -34.15 70.48 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 122.231 1.015 . . . . 0.0 110.794 -178.017 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.501 HD21 HG11 ' A' ' 507' ' ' VAL . 23.7 tp -61.49 -10.62 8.17 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 125.987 1.715 . . . . 0.0 111.776 178.245 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.584 ' HD2' ' O ' ' A' ' 542' ' ' LEU . 9.0 mmpt? -82.57 -12.17 57.91 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.334 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 44.6 m170 -70.96 138.71 50.24 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.861 177.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 95.1 mt -65.62 137.99 57.71 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 121.478 0.656 . . . . 0.0 111.377 -175.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 481' ' ' MET . . . . . 0.497 ' C ' ' HG3' ' A' ' 520' ' ' GLN . 0.9 OUTLIER -67.13 3.28 1.2 Allowed 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.449 -1.251 . . . . 0.0 114.305 -174.235 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 482' ' ' ARG . . . . . 0.454 ' N ' ' HG3' ' A' ' 520' ' ' GLN . 18.8 tpt180 -66.8 -35.17 79.45 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 172.184 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -77.5 59.71 1.96 Allowed 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.363 172.347 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -44.13 -30.3 0.74 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.138 1.375 . . . . 0.0 111.999 177.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -56.73 -58.57 7.51 Favored 'General case' 0 C--O 1.197 -1.663 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.699 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 98.8 m -53.19 -39.35 63.58 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.323 0.649 . . . . 0.0 112.002 -178.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 487' ' ' PHE . . . . . 0.423 ' CE1' ' HB3' ' A' ' 511' ' ' LEU . 41.6 t80 -54.87 -59.48 4.68 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 121.106 0.479 . . . . 0.0 109.985 177.646 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 99.6 mt -81.64 -19.22 42.22 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 120.131 -0.628 . . . . 0.0 112.477 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -70.97 -39.09 72.73 Favored 'General case' 0 CA--C 1.5 -0.97 0 C-N-CA 122.702 0.401 . . . . 0.0 110.23 177.672 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -34.15 53.41 Favored 'General case' 0 N--CA 1.425 -1.679 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -178.259 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -66.36 -24.02 66.43 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 120.188 -0.605 . . . . 0.0 112.457 172.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -88.75 -27.26 21.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 121.029 0.443 . . . . 0.0 111.728 176.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 50.1 m -75.94 -31.02 58.89 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 121.823 -0.548 . . . . 0.0 110.911 -178.014 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 34.3 t -106.89 155.54 7.55 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 177.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -93.24 134.75 35.12 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 119.038 -1.065 . . . . 0.0 108.457 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.46 ' H ' ' HD2' ' A' ' 496' ' ' LYS 0.26 0.1 OUTLIER -89.59 -42.69 11.26 Favored 'General case' 0 C--N 1.285 -2.231 0 N-CA-C 117.55 2.426 . . . . 0.0 117.55 -164.919 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -60.21 -42.64 95.58 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 -165.751 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -93.81 -22.89 18.39 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 119.135 -1.026 . . . . 0.0 112.099 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -81.79 -26.85 34.05 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.136 0.493 . . . . 0.0 111.37 -174.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 89.5 m -71.81 101.39 2.6 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.553 0.692 . . . . 0.0 111.476 -179.348 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -78.4 167.86 20.68 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 171.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -58.59 -25.94 63.12 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.357 0.526 . . . . 0.0 110.212 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 503' ' ' HIS . . . . . 0.655 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 14.8 m80 -57.69 -60.16 4.11 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.76 174.283 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -61.0 -32.22 71.81 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.055 -0.975 . . . . 0.0 112.004 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -64.37 -46.73 82.11 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 123.332 0.653 . . . . 0.0 110.676 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.655 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.266 13.7 p90 -66.06 -36.83 84.26 Favored 'General case' 0 N--CA 1.437 -1.083 0 C-N-CA 118.255 -1.378 . . . . 0.0 111.862 179.856 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 507' ' ' VAL . . . . . 0.501 HG11 HD21 ' A' ' 477' ' ' LEU . 12.9 t -66.5 -53.38 36.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.554 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -48.24 -45.94 34.93 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 124.283 0.989 . . . . 0.0 110.51 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -57.42 -53.56 56.78 Favored 'General case' 0 C--O 1.209 -1.069 0 O-C-N 123.848 0.717 . . . . 0.0 111.649 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 506' ' ' TYR . 21.8 t -55.85 -54.7 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 CA-C-O 121.543 0.687 . . . . 0.0 109.729 -178.431 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.423 ' HB3' ' CE1' ' A' ' 487' ' ' PHE . 7.4 mp -60.88 -53.96 50.9 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.759 -175.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -65.86 -38.03 87.76 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 123.829 0.852 . . . . 0.0 112.304 -177.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -67.52 -40.63 85.08 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 117.469 0.122 . . . . 0.0 111.18 -176.564 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -71.58 -49.05 44.14 Favored 'General case' 0 C--O 1.204 -1.342 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -50.88 -39.75 54.77 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.291 1.036 . . . . 0.0 110.451 178.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -62.11 -29.71 70.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.982 -0.553 . . . . 0.0 112.186 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -107.31 -40.43 5.39 Favored 'General case' 0 C--N 1.307 -1.257 0 C-N-CA 119.884 -0.726 . . . . 0.0 111.388 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -128.21 -176.92 3.95 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.809 -167.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -76.41 -154.84 0.05 Allowed 'General case' 0 C--N 1.293 -1.885 0 C-N-CA 128.002 2.521 . . . . 0.0 112.001 177.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 520' ' ' GLN . . . . . 0.497 ' HG3' ' C ' ' A' ' 481' ' ' MET . 35.1 tt0 -58.51 146.97 33.6 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 125.068 1.347 . . . . 0.0 112.111 -166.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -90.87 146.33 24.01 Favored 'General case' 0 N--CA 1.383 -3.785 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -112.98 157.62 21.27 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.062 -176.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.6 pp -72.11 -10.81 14.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.676 0.751 . . . . 0.0 110.601 178.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 19.4 m -58.38 -38.35 77.12 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.203 170.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -65.12 -36.11 83.25 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.032 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -61.57 -48.84 79.13 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.2 177.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.423 ' O ' HG22 ' A' ' 530' ' ' VAL . 10.6 p -68.36 -28.47 40.7 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-O 121.324 0.583 . . . . 0.0 110.961 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -74.51 -12.14 60.4 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.559 -0.713 . . . . 0.0 110.633 173.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -29.28 47.17 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.502 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 527' ' ' VAL 0.337 30.1 m -73.93 54.02 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -173.592 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -107.07 -29.06 9.62 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 173.385 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 13.0 m -90.33 155.48 18.94 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 172.628 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -69.12 -73.76 0.14 Allowed 'General case' 0 C--O 1.203 -1.359 0 N-CA-C 116.483 2.031 . . . . 0.0 116.483 -172.825 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -80.19 -64.34 1.21 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -164.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 84.5 mt -57.15 -42.49 81.11 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-O 121.702 0.763 . . . . 0.0 112.46 -168.208 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -79.55 -29.31 41.32 Favored 'General case' 0 N--CA 1.398 -3.044 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.962 -175.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -70.03 -39.97 75.46 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 174.018 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.401 ' O ' HD13 ' A' ' 542' ' ' LEU . 40.3 m -54.28 -46.12 72.64 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.892 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 539' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 539' ' ' LEU . 0.4 OUTLIER -60.88 -43.67 98.15 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.631 178.836 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 540' ' ' ILE . . . . . 0.428 HD13 ' HA ' ' A' ' 540' ' ' ILE . 13.8 mm -62.86 -40.71 89.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 CA-C-O 120.836 0.35 . . . . 0.0 110.923 176.228 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.1 m -54.1 -41.42 68.28 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.381 174.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.584 ' O ' ' HD2' ' A' ' 478' ' ' LYS . 10.3 mp -66.79 -49.79 64.72 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.611 172.129 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -54.39 -46.72 73.16 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 125.423 1.489 . . . . 0.0 111.608 -173.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 4.5 pt20 -72.78 12.74 0.46 Allowed 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -176.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -67.03 133.39 49.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 172.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -93.31 92.2 7.58 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.883 -0.727 . . . . 0.0 109.48 -177.627 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 3.5 pp -81.86 -22.78 36.75 Favored 'General case' 0 C--O 1.205 -1.24 0 CA-C-N 115.428 -0.806 . . . . 0.0 112.077 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -75.61 -12.4 60.2 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.932 0.872 . . . . 0.0 110.292 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -71.7 -36.0 70.42 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.454 -1.248 . . . . 0.0 112.26 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -125.16 143.59 44.74 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-O 119.308 -0.377 . . . . 0.0 110.132 -174.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -36.79 129.17 0.49 Allowed 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 124.084 3.189 . . . . 0.0 113.246 174.132 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -79.93 -15.35 57.49 Favored 'General case' 0 CA--C 1.491 -1.299 0 CA-C-O 122.331 1.062 . . . . 0.0 110.502 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -78.8 -12.79 60.04 Favored 'General case' 0 N--CA 1.401 -2.924 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.137 175.765 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -74.09 -36.45 64.28 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 175.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -59.04 -60.13 4.36 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.628 -177.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 31.2 pt -57.74 -34.4 47.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 O-C-N 123.34 0.4 . . . . 0.0 111.935 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -62.77 -56.28 18.98 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.868 0.842 . . . . 0.0 109.234 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 558' ' ' ASP . . . . . 0.627 ' O ' HG23 ' A' ' 562' ' ' VAL . 27.0 t70 -59.45 -50.37 74.19 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.504 -1.225 . . . . 0.0 109.754 178.178 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 559' ' ' TYR . . . . . 0.527 ' O ' HD13 ' A' ' 563' ' ' ILE . 78.0 t80 -50.82 -53.51 31.49 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 125.564 1.546 . . . . 0.0 111.973 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 560' ' ' VAL . . . . . 0.432 ' O ' ' HB3' ' A' ' 564' ' ' ASN . 14.4 p -59.84 -40.14 81.9 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.51 -178.479 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -62.62 -47.65 82.84 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 123.128 0.571 . . . . 0.0 111.287 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 562' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 558' ' ' ASP . 38.2 t -69.81 -30.03 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 C-N-CA 123.87 0.868 . . . . 0.0 112.236 -178.497 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.527 HD13 ' O ' ' A' ' 559' ' ' TYR . 1.3 mp -86.84 -48.98 15.27 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.489 0 CA-C-O 122.222 1.01 . . . . 0.0 109.346 -172.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 564' ' ' ASN . . . . . 0.432 ' HB3' ' O ' ' A' ' 560' ' ' VAL . 26.9 t-20 -78.26 4.35 13.0 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.18 -1.373 . . . . 0.0 109.582 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.478 ' CD ' HH21 ' A' ' 468' ' ' ARG . 2.5 tm-20 -65.3 -28.07 69.06 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 172.361 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 566' ' ' LYS . . . . . 0.456 ' HD2' ' OE1' ' A' ' 469' ' ' GLN . 68.4 mttm -79.48 16.03 1.14 Allowed 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.068 175.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -130.72 -64.26 0.1 OUTLIER Glycine 0 N--CA 1.42 -2.422 0 N-CA-C 106.417 -2.673 . . . . 0.0 106.417 171.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 50.99 105.67 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 127.412 2.285 . . . . 0.0 115.212 173.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -94.96 -178.92 4.65 Favored 'General case' 0 C--N 1.286 -2.152 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 172.714 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.03 162.04 23.04 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.407 ' N ' HD13 ' A' ' 571' ' ' ILE . 0.1 OUTLIER -46.4 -42.62 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.616 0 C-N-CA 125.595 1.558 . . . . 0.0 113.774 -179.456 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.97 -36.43 56.47 Favored 'General case' 0 N--CA 1.417 -2.085 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.551 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 573' ' ' SER . . . . . 0.541 ' O ' ' HB3' ' A' ' 576' ' ' HIS . 24.7 t -69.83 -41.94 74.28 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.786 177.519 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.414 ' O ' ' HG ' ' A' ' 578' ' ' LEU 0.251 3.9 pp -67.39 -32.68 73.75 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 119.675 -0.81 . . . . 0.0 111.146 175.849 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 575' ' ' ASN . . . . . 0.589 ' O ' ' HG3' ' A' ' 579' ' ' ARG . 5.3 t30 -58.81 -49.18 78.66 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 172.223 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 576' ' ' HIS . . . . . 0.541 ' HB3' ' O ' ' A' ' 573' ' ' SER . 3.6 t60 -54.21 -47.85 71.69 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.876 1.27 . . . . 0.0 109.241 176.501 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -60.13 -52.9 63.36 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 123.855 0.862 . . . . 0.0 111.217 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 574' ' ' LEU . 96.8 mt -57.06 -57.41 12.68 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.936 -179.381 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.589 ' HG3' ' O ' ' A' ' 575' ' ' ASN 0.28 0.0 OUTLIER -62.61 -25.9 68.34 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -178.876 . . . . . . . . 4 4 . 1 . 002 nuclear build full ' A' A ' 580' ' ' GLU . . . . . 0.594 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 41.1 tt0 -71.21 -34.94 71.32 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.31 177.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.53 81.38 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.097 0.475 . . . . 0.0 111.258 177.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.614 ' HB ' ' O ' ' A' ' 588' ' ' GLU . 19.8 p -70.28 -28.09 64.93 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-O 122.046 0.926 . . . . 0.0 112.527 -177.196 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.594 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 32.0 ttt-85 -51.42 -2.9 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.266 0 C-N-CA 128.39 2.676 . . . . 0.0 114.582 175.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 17.9 tt -76.17 -11.32 13.91 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.804 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 -171.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 100.89 1.1 55.07 Favored Glycine 0 N--CA 1.487 2.094 0 C-N-CA 119.683 -1.246 . . . . 0.0 113.223 176.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -81.91 167.8 18.57 Favored 'General case' 0 C--N 1.283 -2.322 0 C-N-CA 125.349 1.459 . . . . 0.0 108.43 176.062 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.56 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 55.5 t -48.5 -19.39 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-N 119.68 1.127 . . . . 0.0 110.086 171.0 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.614 ' O ' ' HB ' ' A' ' 582' ' ' THR . 5.9 mm-40 -55.6 -25.32 37.96 Favored 'General case' 0 C--O 1.182 -2.462 0 O-C-N 121.87 -0.519 . . . . 0.0 111.209 167.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 589' ' ' LEU . . . . . 0.61 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 50.8 tp -72.2 -33.35 67.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.707 0.765 . . . . 0.0 109.156 176.624 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 590' ' ' GLN . . . . . 0.56 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 42.5 tt0 -60.34 -41.7 94.15 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 171.157 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 594' ' ' LEU . 25.8 tttm -76.19 -21.44 56.47 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.295 -1.321 . . . . 0.0 111.144 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 592' ' ' TYR . . . . . 0.632 ' HA ' ' OE1' ' A' ' 595' ' ' GLN . 46.7 t80 -59.13 -42.13 89.88 Favored 'General case' 0 CA--C 1.502 -0.868 0 C-N-CA 124.143 0.977 . . . . 0.0 108.681 171.461 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 593' ' ' TYR . . . . . 0.602 ' O ' HG12 ' A' ' 597' ' ' ILE . 42.3 t80 -59.67 -35.14 73.85 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.181 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.461 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 6.9 tt -62.42 -42.77 99.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.052 0.541 . . . . 0.0 110.59 176.601 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.632 ' OE1' ' HA ' ' A' ' 592' ' ' TYR . 9.2 mp0 -67.16 -32.41 73.5 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 120.631 -0.427 . . . . 0.0 110.7 175.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 596' ' ' GLN . . . . . 0.418 ' HB3' ' O ' ' A' ' 593' ' ' TYR . 53.0 tt0 -62.85 -41.46 99.36 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.013 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 593' ' ' TYR . 43.8 mm -56.04 -53.22 41.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 173.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 97.9 t -60.94 -36.31 71.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.228 -178.382 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.455 ' HA ' ' HZ2' ' A' ' 602' ' ' LYS . . . -58.93 -47.95 83.22 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 122.491 0.316 . . . . 0.0 110.184 177.493 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -64.95 -44.61 88.85 Favored 'General case' 0 C--O 1.206 -1.232 0 O-C-N 123.517 0.511 . . . . 0.0 110.423 176.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -60.95 -44.36 97.38 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -177.226 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.542 ' HG3' ' HG3' ' A' ' 603' ' ' GLU . 25.1 pttm -69.74 -43.3 72.58 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.573 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 603' ' ' GLU . . . . . 0.542 ' HG3' ' HG3' ' A' ' 602' ' ' LYS . 31.1 mt-10 -81.97 2.75 29.36 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 123.772 0.829 . . . . 0.0 112.769 -178.143 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -73.06 -29.65 63.13 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 123.514 0.726 . . . . 0.0 109.742 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 64.7 mtt . . . . . 0 C--O 1.246 0.918 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.576 -177.132 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 . . . . . 0 N--CA 1.435 -1.188 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -126.95 40.62 3.68 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 30.1 p-10 -136.17 48.15 2.18 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 113.347 -1.751 . . . . 0.0 109.5 178.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.36 80.84 0.15 Allowed 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 467' ' ' SER . . . . . 0.484 ' OG ' ' HB2' ' A' ' 469' ' ' GLN . 21.9 t -111.27 124.16 51.67 Favored 'General case' 0 N--CA 1.405 -2.71 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -169.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -67.3 -28.84 68.33 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 168.912 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.484 ' HB2' ' OG ' ' A' ' 467' ' ' SER . 1.7 mp0 -68.66 -42.97 77.15 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 124.445 1.098 . . . . 0.0 110.18 -178.41 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.562 ' OE2' ' HB2' ' A' ' 501' ' ' ASN . 0.7 OUTLIER -68.61 -34.8 76.4 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.266 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -63.49 -36.09 82.6 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.178 172.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -62.65 -33.67 75.51 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.299 0.571 . . . . 0.0 109.91 176.834 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 473' ' ' GLU . . . . . 0.423 ' HA ' ' HB2' ' A' ' 476' ' ' PHE . 52.7 mt-10 -73.72 -28.69 61.84 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.808 175.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -69.07 -32.92 72.72 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 173.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -69.4 -40.93 77.06 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.504 174.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 476' ' ' PHE . . . . . 0.423 ' HB2' ' HA ' ' A' ' 473' ' ' GLU . 0.1 OUTLIER -59.37 -27.78 66.27 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.697 176.003 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 477' ' ' LEU . 19.4 mt -69.97 -8.97 53.34 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 178.22 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.489 ' HG3' ' N ' ' A' ' 479' ' ' HIS . 59.3 pttt -43.08 -51.13 5.96 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 124.386 1.054 . . . . 0.0 110.289 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.489 ' N ' ' HG3' ' A' ' 478' ' ' LYS . 3.9 p80 46.29 161.31 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 128.488 2.715 . . . . 0.0 116.218 178.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.425 ' HB2' ' HG2' ' A' ' 482' ' ' ARG . 65.2 mt -143.21 -154.66 0.54 Allowed 'General case' 0 C--N 1.281 -2.407 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 170.637 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.34 -28.27 19.94 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 482' ' ' ARG . . . . . 0.63 ' HG3' ' N ' ' A' ' 483' ' ' ASP . 23.2 ptt180 -64.41 -52.96 55.53 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.991 1.317 . . . . 0.0 113.078 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 483' ' ' ASP . . . . . 0.63 ' N ' ' HG3' ' A' ' 482' ' ' ARG 0.252 1.1 p30 -76.6 31.29 0.13 Allowed 'General case' 0 N--CA 1.419 -1.993 0 N-CA-C 117.172 2.286 . . . . 0.0 117.172 -164.979 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 484' ' ' LYS . . . . . 0.494 ' HD2' ' N ' ' A' ' 485' ' ' ASP . 0.1 OUTLIER -67.41 -28.43 67.91 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 170.695 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 485' ' ' ASP . . . . . 0.494 ' N ' ' HD2' ' A' ' 484' ' ' LYS . 4.7 p-10 -63.05 -44.77 94.92 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.304 174.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.45 ' HB ' ' HB2' ' A' ' 483' ' ' ASP . 43.5 m -65.17 -39.98 93.68 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 124.015 0.926 . . . . 0.0 110.17 -179.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -54.34 -54.46 40.07 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.208 174.423 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 36.2 tp -66.14 -34.22 77.55 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.671 -177.062 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -67.68 -31.13 70.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.714 -178.219 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.61 -41.55 19.35 Favored 'General case' 0 N--CA 1.401 -2.907 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.99 -52.11 66.87 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.264 1.826 . . . . 0.0 110.831 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.39 -20.08 59.15 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.313 -173.216 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 59.4 m -81.13 -47.23 13.77 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 119.917 -0.713 . . . . 0.0 111.982 -174.709 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 40.1 t -137.31 123.43 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 C-N-CA 120.464 -0.494 . . . . 0.0 109.813 -175.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -86.63 45.64 1.27 Allowed 'General case' 0 CA--C 1.55 0.965 0 CA-C-O 122.606 1.193 . . . . 0.0 110.146 -177.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.418 ' HG2' ' H ' ' A' ' 496' ' ' LYS . 50.9 pttt -89.16 14.83 9.92 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.659 -177.3 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.27 -11.05 48.1 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 -170.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -84.66 -22.66 29.78 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.875 0.845 . . . . 0.0 109.14 175.371 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -79.99 -43.58 21.75 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.4 m -54.94 154.05 5.69 Favored 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.876 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.562 ' HB2' ' OE2' ' A' ' 470' ' ' GLU . 12.7 t-20 -66.42 150.02 49.54 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 124.806 1.242 . . . . 0.0 111.496 -174.533 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -65.41 -21.73 66.7 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.048 0.539 . . . . 0.0 110.313 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 503' ' ' HIS . . . . . 0.645 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 49.3 m80 -61.43 -44.25 97.45 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -65.78 -31.73 72.87 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.331 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 508' ' ' PHE . 46.8 tttm -61.81 -52.93 62.15 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 122.635 0.374 . . . . 0.0 110.594 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.645 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.282 47.0 p90 -66.2 -25.19 66.81 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 117.516 -1.674 . . . . 0.0 111.863 -179.796 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 97.4 t -72.53 -40.38 63.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.367 174.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 508' ' ' PHE . . . . . 0.41 ' HB2' ' O ' ' A' ' 505' ' ' LYS . 8.2 m-85 -48.67 -50.47 32.97 Favored 'General case' 0 C--O 1.199 -1.6 0 C-N-CA 123.399 0.679 . . . . 0.0 109.526 171.139 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 509' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 513' ' ' ASP . 38.6 mt-10 -57.28 -49.7 75.26 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.371 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 506' ' ' TYR . 9.9 t -60.43 -53.82 43.51 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.832 0 O-C-N 123.75 0.656 . . . . 0.0 109.262 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.433 ' HA ' ' HB2' ' A' ' 514' ' ' PHE . 95.8 mt -69.24 -32.29 71.41 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 113.431 0.9 . . . . 0.0 113.431 -174.515 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -67.07 -49.47 64.99 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.237 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 513' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 509' ' ' GLU . 0.4 OUTLIER -58.55 -38.39 77.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.368 173.843 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 514' ' ' PHE . . . . . 0.75 ' O ' ' HA ' ' A' ' 518' ' ' ASN . 13.8 m-85 -75.75 -3.87 37.29 Favored 'General case' 0 C--O 1.186 -2.279 0 C-N-CA 124.886 1.275 . . . . 0.0 114.31 174.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 515' ' ' TYR . . . . . 0.499 ' O ' ' HB3' ' A' ' 518' ' ' ASN . 2.6 m-85 -82.83 -35.62 26.22 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 121.154 -0.966 . . . . 0.0 110.356 165.778 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -68.61 -47.17 67.35 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 170.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -99.02 61.45 1.25 Allowed 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 104.752 -2.314 . . . . 0.0 104.752 174.142 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 518' ' ' ASN . . . . . 0.75 ' HA ' ' O ' ' A' ' 514' ' ' PHE . 3.1 p-10 -59.61 -151.27 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 128.844 2.858 . . . . 0.0 116.125 -163.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . 0.358 3.3 p30 -31.54 -152.75 0.0 OUTLIER 'General case' 0 N--CA 1.528 3.441 0 N-CA-C 119.605 3.187 . . . . 0.0 119.605 -138.334 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -53.18 125.07 16.28 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 124.01 1.862 . . . . 0.0 114.937 -145.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.83 176.58 6.21 Favored 'General case' 0 N--CA 1.416 -2.134 0 CA-C-N 109.648 -3.433 . . . . 0.0 110.483 -168.466 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -108.03 136.51 47.6 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -174.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 36.8 pt -79.19 -14.48 13.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 175.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.469 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 37.0 t -57.13 -30.97 64.87 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.642 172.071 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -63.03 -42.58 99.82 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -62.17 -45.27 94.17 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.295 177.227 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 530' ' ' VAL . 61.8 t -62.1 -26.07 39.12 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.702 0 CA-C-O 121.493 0.663 . . . . 0.0 111.186 175.463 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 528' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 524' ' ' SER . 21.7 mm-40 -71.16 -23.53 62.08 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 120.759 -1.213 . . . . 0.0 109.709 174.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.455 ' O ' ' HD3' ' A' ' 536' ' ' ARG . 16.2 m-85 -70.61 -31.71 68.78 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.901 174.231 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 527' ' ' VAL 0.326 14.6 p -74.97 54.73 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.321 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -172.406 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -107.02 -42.26 4.95 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 173.502 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 532' ' ' SER . . . . . 0.416 ' HB2' ' HD2' ' A' ' 536' ' ' ARG . 11.7 m -79.0 141.44 37.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 106.004 -1.85 . . . . 0.0 106.004 171.229 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -68.11 -84.0 0.03 OUTLIER 'General case' 0 C--O 1.198 -1.641 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 -173.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -52.63 -64.98 0.64 Allowed 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 116.113 1.894 . . . . 0.0 116.113 -166.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 44.8 tp -57.14 -57.05 14.3 Favored 'General case' 0 C--O 1.267 2.004 0 CA-C-O 122.579 1.18 . . . . 0.0 111.299 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.455 ' HD3' ' O ' ' A' ' 529' ' ' TYR . 62.8 mtt85 -76.19 -38.25 56.79 Favored 'General case' 0 N--CA 1.41 -2.462 0 CA-C-N 114.11 -1.405 . . . . 0.0 113.686 -171.44 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -61.27 -43.88 98.15 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 118.243 0.474 . . . . 0.0 110.042 175.3 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.469 ' O ' HD13 ' A' ' 542' ' ' LEU . 93.4 m -55.44 -43.39 75.37 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 123.779 0.674 . . . . 0.0 111.045 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 539' ' ' LEU . . . . . 0.459 ' HB2' ' OH ' ' A' ' 506' ' ' TYR . 0.4 OUTLIER -57.9 -45.3 86.67 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.514 177.465 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 540' ' ' ILE . . . . . 0.595 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 1.7 mp -58.28 -43.96 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 CA-C-O 121.009 0.433 . . . . 0.0 110.368 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 19.8 m -54.5 -41.98 70.23 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.211 174.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 538' ' ' THR . 9.1 mp -62.83 -42.12 99.6 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.909 0.484 . . . . 0.0 110.472 175.573 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 543' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 478' ' ' LYS . 40.5 tt0 -61.1 -37.23 82.01 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.166 0.986 . . . . 0.0 111.78 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 544' ' ' GLN . . . . . 0.595 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 72.8 mt-30 -68.83 -29.0 67.24 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.138 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -76.96 84.4 3.49 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-O 121.767 0.794 . . . . 0.0 111.576 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -136.87 136.58 38.85 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.568 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 6.8 mp -90.35 23.54 2.9 Favored 'General case' 0 C--N 1.299 -1.596 0 C-N-CA 124.288 1.035 . . . . 0.0 111.209 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.08 -23.34 66.44 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -170.537 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -70.08 -15.49 62.99 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.891 0.377 . . . . 0.0 111.033 176.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -117.61 118.32 35.26 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -84.63 38.74 0.7 Allowed 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.948 2.432 . . . . 0.0 110.968 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -128.5 48.61 2.29 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -70.03 66.82 0.27 Allowed 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -175.586 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.07 -21.86 65.87 Favored 'General case' 0 C--O 1.214 -0.789 0 C-N-CA 125.657 1.583 . . . . 0.0 109.114 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -45.37 -38.44 5.87 Favored 'General case' 0 C--O 1.197 -1.659 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.89 174.021 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 43.9 mt -70.93 -42.24 77.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 123.283 0.633 . . . . 0.0 109.545 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -60.49 -47.3 86.75 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 121.957 0.884 . . . . 0.0 109.389 176.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -57.64 -48.54 79.18 Favored 'General case' 0 C--O 1.211 -0.954 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.296 175.673 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 559' ' ' TYR . . . . . 0.446 ' O ' HG13 ' A' ' 563' ' ' ILE . 27.9 t80 -56.89 -53.86 53.17 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 125.47 1.508 . . . . 0.0 110.42 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 40.4 t -58.4 -54.98 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.225 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.598 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.428 ' ND2' ' HB2' ' A' ' 576' ' ' HIS . 2.4 t30 -63.68 -42.78 97.98 Favored 'General case' 0 C--O 1.181 -2.502 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.994 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 2.6 p -65.75 -33.64 64.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 118.158 0.435 . . . . 0.0 112.108 -173.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 559' ' ' TYR . 27.9 mt -84.82 -29.24 6.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.538 0.685 . . . . 0.0 109.567 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -78.47 -36.19 45.61 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.668 -178.692 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 561' ' ' ASN . 12.3 pt-20 -75.09 -7.65 54.34 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 122.186 0.993 . . . . 0.0 110.401 -177.999 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -72.11 -26.13 62.01 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.988 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -93.72 -24.36 20.9 Favored Glycine 0 N--CA 1.436 -1.363 0 C-N-CA 119.77 -1.205 . . . . 0.0 112.571 -176.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 568' ' ' GLN . . . . . 0.569 ' HG2' ' HG3' ' A' ' 569' ' ' GLU . 4.6 pm0 -174.36 166.26 4.01 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -176.56 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 569' ' ' GLU . . . . . 0.569 ' HG3' ' HG2' ' A' ' 568' ' ' GLN . 42.0 mt-10 79.39 133.19 0.06 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.967 1.307 . . . . 0.0 113.042 176.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 570' ' ' THR . . . . . 0.433 ' O ' ' HB2' ' A' ' 573' ' ' SER . 23.8 m -127.01 -37.47 2.09 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.901 -176.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 4.0 mt -75.51 -24.02 17.0 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.171 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 572' ' ' GLU . . . . . 0.524 ' OE1' ' HG2' ' A' ' 602' ' ' LYS . 43.7 mm-40 -74.88 -22.88 58.39 Favored 'General case' 0 N--CA 1.409 -2.516 0 CA-C-N 113.579 -1.646 . . . . 0.0 111.014 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 573' ' ' SER . . . . . 0.433 ' HB2' ' O ' ' A' ' 570' ' ' THR . 66.6 m -63.26 -35.64 81.0 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 173.077 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.548 ' O ' ' HB3' ' A' ' 577' ' ' LYS . 50.1 mt -65.6 -41.34 92.89 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.165 174.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 575' ' ' ASN . . . . . 0.483 ' O ' ' HG3' ' A' ' 579' ' ' ARG . 28.5 t-20 -60.59 -40.58 92.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.24 176.192 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 576' ' ' HIS . . . . . 0.428 ' HB2' ' ND2' ' A' ' 561' ' ' ASN . 13.5 t-160 -56.43 -47.26 79.45 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 175.595 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 577' ' ' LYS . . . . . 0.548 ' HB3' ' O ' ' A' ' 574' ' ' LEU . 80.0 tttt -48.95 -47.23 43.99 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.461 0.705 . . . . 0.0 111.372 176.776 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 71.7 mt -58.1 -51.9 67.76 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.324 0.649 . . . . 0.0 111.322 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.796 ' O ' ' HB ' ' A' ' 582' ' ' THR . 8.5 mtm-85 -66.35 -34.96 79.14 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 122.541 1.162 . . . . 0.0 110.412 -178.822 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 580' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 583' ' ' ARG . 36.7 tt0 -61.33 -44.62 96.88 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.162 174.365 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -60.09 -33.72 72.47 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.747 0.784 . . . . 0.0 110.05 175.757 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.796 ' HB ' ' O ' ' A' ' 579' ' ' ARG . 16.0 m -61.89 -33.6 74.51 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 125.93 1.692 . . . . 0.0 113.002 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 580' ' ' GLU . 34.9 ptt180 -50.11 -13.64 0.12 Allowed 'General case' 0 N--CA 1.515 2.801 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -178.52 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 20.2 tt -77.85 -6.35 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.714 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -171.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 85.78 15.16 66.1 Favored Glycine 0 N--CA 1.472 1.097 0 C-N-CA 119.932 -1.128 . . . . 0.0 113.075 176.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -83.16 166.07 18.96 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 106.97 -1.492 . . . . 0.0 106.97 175.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.53 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 35.6 m -54.63 -4.67 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 CA-C-N 119.649 1.113 . . . . 0.0 112.568 173.16 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.545 ' HA ' ' HB3' ' A' ' 591' ' ' LYS . 31.8 mt-10 -59.79 -14.97 17.05 Favored 'General case' 0 C--O 1.191 -1.995 0 O-C-N 121.837 -0.54 . . . . 0.0 110.293 164.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 589' ' ' LEU . . . . . 0.48 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 6.4 tt -71.81 -41.19 68.55 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 172.725 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 590' ' ' GLN . . . . . 0.53 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 46.3 tt0 -57.26 -36.51 71.06 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-O 122.182 0.992 . . . . 0.0 108.606 170.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.564 ' O ' ' HG2' ' A' ' 595' ' ' GLN . 84.5 tttt -71.56 -30.66 66.11 Favored 'General case' 0 C--O 1.19 -2.035 0 CA-C-N 114.059 -1.428 . . . . 0.0 110.522 176.409 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 592' ' ' TYR . . . . . 0.527 ' HB2' HG21 ' A' ' 582' ' ' THR . 84.1 t80 -57.32 -42.16 81.31 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 124.148 0.979 . . . . 0.0 109.047 175.753 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 593' ' ' TYR . . . . . 0.43 ' O ' HG13 ' A' ' 597' ' ' ILE . 61.1 t80 -58.49 -44.94 89.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.8 177.305 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.492 ' O ' HG23 ' A' ' 598' ' ' VAL . 56.3 tp -62.94 -44.59 95.66 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.471 175.369 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.564 ' HG2' ' O ' ' A' ' 591' ' ' LYS . 83.4 mm-40 -60.23 -42.65 95.68 Favored 'General case' 0 CA--C 1.509 -0.617 0 C-N-CA 123.547 0.739 . . . . 0.0 112.274 -177.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 -67.01 -37.01 83.41 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.067 -0.653 . . . . 0.0 109.354 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 593' ' ' TYR . 67.0 mt -58.44 -45.15 89.97 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 172.945 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 598' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 594' ' ' LEU . 99.5 t -61.42 -40.05 84.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 C-N-CA 123.114 0.566 . . . . 0.0 110.353 178.038 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -61.18 -46.99 88.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.114 176.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -63.57 -39.88 95.54 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.803 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -60.81 -41.59 95.98 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.967 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.524 ' HG2' ' OE1' ' A' ' 572' ' ' GLU 0.268 0.0 OUTLIER -72.09 -28.41 63.28 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 119.247 -0.981 . . . . 0.0 112.666 178.459 . . . . . . . . 4 4 . 1 . 003 nuclear build full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -74.01 -33.6 63.86 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 174.299 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -68.01 -42.45 80.69 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 123.892 0.877 . . . . 0.0 111.125 177.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 56.5 ttm . . . . . 0 C--N 1.308 -1.228 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.152 -177.294 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 13.8 p90 . . . . . 0 N--CA 1.411 -2.394 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -93.67 135.3 35.09 Favored 'General case' 0 C--N 1.284 -2.24 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 173.856 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -128.32 69.58 1.36 Allowed 'General case' 0 C--N 1.286 -2.181 0 CA-C-O 121.827 0.822 . . . . 0.0 110.059 -178.152 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.93 116.82 8.21 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 113.93 -1.486 . . . . 0.0 108.492 174.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 467' ' ' SER . . . . . 0.547 ' O ' ' HG2' ' A' ' 470' ' ' GLU . 47.3 t -95.05 141.09 29.1 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.681 -174.756 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -65.67 -22.42 66.64 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.252 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -62.26 -36.93 83.57 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.46 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 467' ' ' SER . 14.4 pt-20 -74.96 -23.92 58.37 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.723 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -71.35 -36.49 71.52 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -63.04 -48.41 78.83 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.59 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -56.66 -41.7 77.71 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.179 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 9.9 mmt-85 -57.41 -40.89 79.27 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.163 0.506 . . . . 0.0 109.89 175.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 475' ' ' ALA . . . . . 0.647 ' O ' ' HG3' ' A' ' 478' ' ' LYS . . . -65.54 -40.22 92.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.939 -178.449 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.57 -48.04 76.48 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.857 0.837 . . . . 0.0 110.81 173.077 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 31.8 tp -70.26 -3.17 15.84 Favored 'General case' 0 CA--C 1.571 1.761 0 C-N-CA 126.289 1.836 . . . . 0.0 114.456 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.647 ' HG3' ' O ' ' A' ' 475' ' ' ALA . 35.4 mtmm -41.66 -63.47 0.71 Allowed 'General case' 0 N--CA 1.511 2.579 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -172.214 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.535 ' CG ' ' HA ' ' A' ' 543' ' ' GLU . 0.4 OUTLIER -170.15 89.7 0.16 Allowed 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 121.918 0.866 . . . . 0.0 110.425 -179.447 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.549 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 96.1 mt -133.12 100.27 4.82 Favored 'General case' 0 C--N 1.278 -2.511 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -83.6 -72.68 0.45 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 114.44 -1.255 . . . . 0.0 112.036 -171.203 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -9.02 50.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 -179.202 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 483' ' ' ASP . . . . . 0.549 ' HB2' ' HB3' ' A' ' 480' ' ' LEU . 0.7 OUTLIER -70.79 57.67 0.2 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 125.152 1.381 . . . . 0.0 113.957 -177.524 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 484' ' ' LYS . . . . . 0.418 ' HE3' ' OH ' ' A' ' 515' ' ' TYR . 20.6 ptmt -54.95 -40.59 70.11 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 123.572 0.749 . . . . 0.0 111.321 178.148 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -63.39 -44.96 93.2 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.543 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 26.8 m -62.68 -39.06 92.76 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.208 0.203 . . . . 0.0 111.365 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 487' ' ' PHE . . . . . 0.441 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 61.6 t80 -56.02 -49.64 73.12 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 176.586 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.9 -31.71 66.67 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.941 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -68.58 -37.71 80.09 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.951 0.9 . . . . 0.0 111.571 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -84.67 -23.66 29.32 Favored 'General case' 0 N--CA 1.413 -2.298 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.21 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 491' ' ' TYR . . . . . 0.441 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.1 OUTLIER -65.12 -46.11 82.32 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 176.213 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.38 -6.91 56.58 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.273 0.559 . . . . 0.0 111.247 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 36.8 t -78.8 -18.4 54.18 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 37.7 t -129.03 98.09 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.93 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.865 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -99.25 -6.75 27.5 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 171.552 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -88.45 18.87 4.18 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 127.212 2.205 . . . . 0.0 109.62 177.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -61.16 -0.62 0.36 Allowed 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 -172.868 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -75.75 -12.91 60.27 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 175.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -77.36 -12.84 60.0 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 114.297 -1.319 . . . . 0.0 110.941 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 14.1 p -54.98 133.49 48.46 Favored 'General case' 0 CA--C 1.485 -1.546 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -170.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 43.4 t-20 -73.73 137.9 44.29 Favored 'General case' 0 N--CA 1.413 -2.282 0 N-CA-C 104.551 -2.388 . . . . 0.0 104.551 170.663 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 502' ' ' GLN . . . . . 0.436 ' O ' ' HD1' ' A' ' 506' ' ' TYR . 46.4 tt0 -62.23 -18.58 61.54 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 118.858 0.754 . . . . 0.0 110.985 -172.825 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -60.36 -41.98 94.81 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.054 175.566 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -63.56 -36.71 84.7 Favored 'General case' 0 C--O 1.209 -1.029 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.229 174.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 1.2 tmtp? -64.11 -36.07 82.83 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.074 -175.855 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.556 ' O ' HG23 ' A' ' 510' ' ' VAL . 45.6 m-85 -60.3 -54.09 49.87 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.964 172.022 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.82 -48.22 88.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.593 -177.529 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -49.82 -49.9 47.22 Favored 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 123.363 0.414 . . . . 0.0 111.636 176.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -57.92 -49.11 77.88 Favored 'General case' 0 N--CA 1.461 0.123 0 O-C-N 123.698 0.624 . . . . 0.0 110.413 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 506' ' ' TYR . 60.2 t -55.36 -58.85 3.3 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.561 0 O-C-N 123.786 0.679 . . . . 0.0 110.707 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 9.5 mp -66.27 -44.5 83.41 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.04 -175.263 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 50.9 t-80 -62.17 -53.06 60.66 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.977 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.4 -29.32 63.63 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -173.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 21.7 m-30 -76.68 -47.55 21.7 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.659 177.712 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 515' ' ' TYR . . . . . 0.418 ' OH ' ' HE3' ' A' ' 484' ' ' LYS . 0.6 OUTLIER -52.3 -43.55 64.54 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.591 1.156 . . . . 0.0 109.466 176.246 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -68.65 -9.61 51.09 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -121.49 -48.23 2.19 Favored 'General case' 0 C--N 1.313 -1.014 0 O-C-N 121.917 -0.49 . . . . 0.0 111.694 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -121.16 -151.01 0.47 Allowed 'General case' 0 C--N 1.29 -1.984 0 C-N-CA 123.563 0.745 . . . . 0.0 109.386 -177.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.84 -160.62 0.16 Allowed 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -75.56 179.83 5.08 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.988 -0.445 . . . . 0.0 110.173 -178.251 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 521' ' ' TYR . . . . . 0.406 ' CD2' ' HB2' ' A' ' 525' ' ' ASP . 0.1 OUTLIER -88.55 138.35 31.5 Favored 'General case' 0 N--CA 1.384 -3.729 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -176.8 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -119.29 175.8 5.63 Favored 'General case' 0 C--N 1.286 -2.183 0 CA-C-N 116.946 -0.115 . . . . 0.0 110.796 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 35.0 pt -68.73 -18.56 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.302 0.573 . . . . 0.0 110.992 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 3.5 p -59.71 -41.33 90.58 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-O 121.787 0.803 . . . . 0.0 109.741 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 525' ' ' ASP . . . . . 0.406 ' HB2' ' CD2' ' A' ' 521' ' ' TYR . 40.9 m-20 -66.82 -36.91 83.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.001 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -59.8 -49.57 77.19 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.273 178.036 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 9.5 p -68.15 -23.62 28.98 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.721 0 CA-C-O 120.903 0.382 . . . . 0.0 110.909 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 528' ' ' GLN . . . . . 0.482 ' HG3' ' O ' ' A' ' 524' ' ' SER . 98.6 mt-30 -67.28 -30.37 70.22 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 173.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.401 ' C ' ' H ' ' A' ' 531' ' ' ASN . 0.3 OUTLIER -83.17 16.59 2.35 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 173.497 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.417 HG23 ' HG3' ' A' ' 536' ' ' ARG . 5.2 p -71.63 18.89 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 CA-C-O 121.928 0.871 . . . . 0.0 111.729 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 531' ' ' ASN . . . . . 0.401 ' H ' ' C ' ' A' ' 529' ' ' TYR . 10.4 p30 -107.86 -26.16 10.88 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.579 -0.701 . . . . 0.0 111.036 -178.611 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 532' ' ' SER . . . . . 0.445 ' HB2' ' HB2' ' A' ' 535' ' ' LEU . 24.8 m -92.2 140.03 30.03 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 179.467 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 533' ' ' ASN . . . . . 0.539 ' O ' ' HG2' ' A' ' 537' ' ' GLU . 19.3 m120 -57.84 -72.23 0.09 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -170.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -66.39 -32.45 73.85 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 120.67 0.271 . . . . 0.0 111.158 -174.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 532' ' ' SER . 3.7 mm? -61.88 -50.51 71.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.391 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.417 ' HG3' HG23 ' A' ' 530' ' ' VAL . 48.4 ttt180 -62.3 -61.53 2.39 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.869 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 537' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 533' ' ' ASN . 12.7 pt-20 -61.22 -62.27 1.96 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -173.207 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.482 ' O ' HD13 ' A' ' 542' ' ' LEU . 75.7 m -65.27 -53.77 39.21 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 539' ' ' LEU . . . . . 0.435 ' HB3' ' O ' ' A' ' 535' ' ' LEU . 47.4 tp -61.38 -44.03 97.85 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.468 -174.697 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 57.2 mt -68.18 -34.83 68.68 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.492 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 28.7 t -57.35 -49.22 76.84 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 121.555 0.693 . . . . 0.0 109.477 174.999 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.482 HD13 ' O ' ' A' ' 538' ' ' THR . 6.5 mp -66.96 -24.41 66.05 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.979 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 543' ' ' GLU . . . . . 0.535 ' HA ' ' CG ' ' A' ' 479' ' ' HIS . 0.9 OUTLIER -81.42 -64.7 1.13 Allowed 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.04 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 58.5 tp60 -71.67 -59.59 2.68 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.857 -171.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -73.04 90.28 1.5 Allowed 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -173.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -137.26 100.17 4.18 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 173.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 5.5 tt -92.35 -82.54 0.32 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 118.589 -1.244 . . . . 0.0 111.518 -173.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -104.66 -48.99 3.64 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-O 121.743 0.782 . . . . 0.0 112.137 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -68.23 36.25 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 126.842 2.057 . . . . 0.0 113.824 -172.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.44 ' HA ' ' HD3' ' A' ' 551' ' ' PRO . 12.2 pt-20 -54.97 106.11 0.62 Allowed Pre-proline 0 C--O 1.244 0.798 0 C-N-CA 123.479 0.711 . . . . 0.0 112.174 -179.456 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 551' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 550' ' ' GLU . 43.6 Cg_endo -92.72 111.55 0.24 Allowed 'Trans proline' 0 N--CA 1.426 -2.443 0 C-N-CA 122.596 2.197 . . . . 0.0 114.389 -173.766 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -131.26 -54.14 1.03 Allowed 'General case' 0 CA--C 1.494 -1.209 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 172.266 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -75.02 -50.22 17.23 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 113.853 -1.521 . . . . 0.0 108.585 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -67.1 -24.16 65.91 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 114.27 -1.332 . . . . 0.0 109.052 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 555' ' ' GLU . . . . . 0.426 ' CD ' ' HB1' ' A' ' 475' ' ' ALA . 6.1 tp10 -68.07 -56.61 8.25 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.58 -177.237 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 72.8 mt -54.71 -40.92 53.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.21 -51.67 68.79 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.431 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -66.16 -49.45 67.34 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.192 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 559' ' ' TYR . . . . . 0.613 ' O ' HG12 ' A' ' 563' ' ' ILE . 87.5 t80 -51.49 -53.44 37.37 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 125.352 1.461 . . . . 0.0 110.233 178.644 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 75.7 t -61.41 -45.92 97.64 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.985 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -58.46 -39.72 80.68 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.741 0.416 . . . . 0.0 111.324 -179.426 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 76.3 t -70.12 -34.87 61.05 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 123.187 0.595 . . . . 0.0 112.246 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.613 HG12 ' O ' ' A' ' 559' ' ' TYR . 47.7 mm -86.37 -38.32 12.42 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -174.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 564' ' ' ASN . . . . . 0.464 ' HA ' ' HA3' ' A' ' 567' ' ' GLY . 53.7 t30 -76.82 0.14 21.83 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 113.956 -1.475 . . . . 0.0 109.646 178.624 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -64.54 -36.17 83.35 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 104.781 -2.303 . . . . 0.0 104.781 173.391 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 566' ' ' LYS . . . . . 0.433 ' O ' ' HG2' ' A' ' 566' ' ' LYS . 54.1 tttm -116.0 25.9 10.37 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 113.525 -1.67 . . . . 0.0 108.27 -179.473 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 567' ' ' GLY . . . . . 0.464 ' HA3' ' HA ' ' A' ' 564' ' ' ASN . . . -99.39 73.13 0.5 Allowed Glycine 0 N--CA 1.424 -2.134 0 C-N-CA 120.001 -1.095 . . . . 0.0 114.479 -171.048 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -95.13 110.35 22.31 Favored 'General case' 0 C--N 1.288 -2.089 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.61 172.554 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 72.02 152.88 0.12 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.185 1.394 . . . . 0.0 110.332 -173.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 31.7 m 71.29 -60.21 0.52 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.947 1.299 . . . . 0.0 111.236 -177.168 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.452 ' O ' ' HB2' ' A' ' 574' ' ' LEU . 4.7 mm -75.15 -22.9 16.95 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.903 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 -177.386 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 572' ' ' GLU . . . . . 0.507 ' O ' ' HB3' ' A' ' 575' ' ' ASN . 56.4 mt-10 -71.22 -15.89 62.48 Favored 'General case' 0 N--CA 1.422 -1.861 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.079 178.728 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 47.1 t -68.46 -36.78 79.47 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 171.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 571' ' ' ILE . 7.8 mp -65.36 -16.79 63.96 Favored 'General case' 0 C--O 1.206 -1.23 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.165 175.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 575' ' ' ASN . . . . . 0.507 ' HB3' ' O ' ' A' ' 572' ' ' GLU . 21.2 t-20 -58.36 -46.99 85.23 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 170.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . 0.524 2.8 p80 -68.31 -34.22 75.75 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 173.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 577' ' ' LYS . . . . . 0.552 ' O ' ' HB3' ' A' ' 580' ' ' GLU . 0.3 OUTLIER -65.21 -32.43 74.11 Favored 'General case' 0 CA--C 1.564 1.504 0 CA-C-O 121.14 0.495 . . . . 0.0 110.371 174.697 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 40.6 tp -57.02 -46.14 82.56 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.652 ' O ' ' HD3' ' A' ' 579' ' ' ARG . 0.0 OUTLIER -60.18 -36.77 78.34 Favored 'General case' 0 CA--C 1.562 1.413 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.924 175.73 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 580' ' ' GLU . . . . . 0.6 ' O ' ' HG2' ' A' ' 583' ' ' ARG . 26.1 tt0 -60.06 -50.55 73.28 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 123.362 0.665 . . . . 0.0 110.677 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -60.07 -44.85 94.45 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.618 0.723 . . . . 0.0 111.002 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.519 ' HB ' ' CB ' ' A' ' 588' ' ' GLU . 40.2 p -69.77 -25.2 63.69 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 -175.516 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 580' ' ' GLU . 6.7 ptp180 -51.12 -2.91 0.02 OUTLIER 'General case' 0 N--CA 1.513 2.693 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 -176.216 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 31.2 pt -74.95 -3.4 4.71 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -173.111 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 120.95 -0.83 11.85 Favored Glycine 0 N--CA 1.476 1.351 0 C-N-CA 118.6 -1.762 . . . . 0.0 115.082 172.089 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -74.8 165.63 24.93 Favored 'General case' 0 C--N 1.298 -1.645 0 C-N-CA 122.986 0.514 . . . . 0.0 110.334 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.571 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 13.5 t -56.92 -5.15 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.156 0 C-N-CA 125.79 1.636 . . . . 0.0 110.166 177.6 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.519 ' CB ' ' HB ' ' A' ' 582' ' ' THR . 8.9 mm-40 -61.09 -15.04 28.46 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 123.299 0.64 . . . . 0.0 109.596 169.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 589' ' ' LEU . . . . . 0.539 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 65.3 tp -70.53 -35.26 73.07 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.336 -0.986 . . . . 0.0 108.336 171.501 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 590' ' ' GLN . . . . . 0.571 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 6.6 tp-100 -61.48 -39.08 89.61 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 172.19 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.523 ' O ' ' HB3' ' A' ' 594' ' ' LEU . 98.6 mttt -72.16 -23.4 61.28 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.83 174.417 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 592' ' ' TYR . . . . . 0.539 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 43.8 t80 -58.38 -40.01 81.17 Favored 'General case' 0 C--O 1.211 -0.927 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 173.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -52.31 -48.63 65.29 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 173.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.523 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 15.6 tp -59.49 -52.87 63.72 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.566 0.746 . . . . 0.0 110.249 176.153 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.423 ' NE2' ' HB2' ' A' ' 599' ' ' ALA . 22.7 tm0? -62.4 -38.24 88.9 Favored 'General case' 0 C--O 1.202 -1.418 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.373 -174.452 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 596' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 600' ' ' LYS . 23.6 tp60 -62.45 -42.69 99.65 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.379 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 87.8 mt -58.98 -50.67 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 123.613 0.57 . . . . 0.0 110.534 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 70.1 t -65.35 -41.68 91.85 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.448 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.059 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.423 ' HB2' ' NE2' ' A' ' 595' ' ' GLN . . . -64.27 -34.13 77.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.001 0.429 . . . . 0.0 110.335 176.968 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 600' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 596' ' ' GLN . 21.7 tptt -65.54 -46.87 77.89 Favored 'General case' 0 C--O 1.208 -1.127 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 176.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 601' ' ' ASN . . . . . 0.491 ' HA ' ' HD2' ' A' ' 604' ' ' ARG . 78.8 m-20 -67.23 -28.27 67.92 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.598 177.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.552 ' HG3' ' HG3' ' A' ' 603' ' ' GLU . 0.4 OUTLIER -67.64 -65.72 0.65 Allowed 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.025 175.317 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 603' ' ' GLU . . . . . 0.552 ' HG3' ' HG3' ' A' ' 602' ' ' LYS . 52.2 mt-10 -89.33 19.35 4.46 Favored 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -173.79 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 604' ' ' ARG . . . . . 0.491 ' HD2' ' HA ' ' A' ' 601' ' ' ASN . 15.9 ptm180 -72.83 -7.99 53.41 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.567 0.698 . . . . 0.0 109.654 172.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 60.3 ttp . . . . . 0 N--CA 1.423 -1.79 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.023 179.165 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 12.7 p90 . . . . . 0 N--CA 1.446 -0.665 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -70.45 153.08 43.33 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.579 0.228 . . . . 0.0 111.512 -177.526 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -91.64 47.82 1.4 Allowed 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -178.296 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.23 95.12 0.4 Allowed 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.385 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 67.2 p -101.94 -177.84 3.53 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.191 -174.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.3 ptt180 -69.36 -18.19 63.76 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.235 173.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.434 ' HA ' HG12 ' A' ' 562' ' ' VAL . 98.6 mt-30 -57.54 -67.62 0.31 Allowed 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 -168.613 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.494 ' HA ' ' CB ' ' A' ' 473' ' ' GLU 0.449 11.7 pt-20 -77.1 -9.06 58.49 Favored 'General case' 0 N--CA 1.421 -1.887 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -177.957 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -67.07 -44.46 80.03 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 170.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 472' ' ' ALA . . . . . 0.467 ' HB3' HD11 ' A' ' 563' ' ' ILE . . . -67.86 -27.78 66.98 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.768 0.794 . . . . 0.0 109.184 176.256 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 473' ' ' GLU . . . . . 0.494 ' CB ' ' HA ' ' A' ' 470' ' ' GLU . 0.1 OUTLIER -70.18 -45.14 67.3 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 114.67 -1.15 . . . . 0.0 108.541 177.801 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 67.7 mtt180 -57.06 -35.31 69.19 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.19 0.519 . . . . 0.0 110.89 172.364 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 475' ' ' ALA . . . . . 0.401 ' HA ' HD12 ' A' ' 542' ' ' LEU . . . -69.5 -39.35 77.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.591 175.885 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 476' ' ' PHE . . . . . 0.554 ' O ' ' HB2' ' A' ' 479' ' ' HIS . 4.2 t80 -64.49 -38.39 90.84 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 123.69 0.796 . . . . 0.0 110.097 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 56.3 tp -63.47 -43.35 97.57 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.44 1.096 . . . . 0.0 111.162 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -74.61 -53.37 9.49 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.554 ' HB2' ' O ' ' A' ' 476' ' ' PHE . 1.7 t-80 40.05 -97.15 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.096 2.159 . . . . 0.0 113.326 177.292 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.457 ' H ' ' HB3' ' A' ' 479' ' ' HIS . 3.2 mm? -136.27 153.24 51.25 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 173.648 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 481' ' ' MET . . . . . 0.567 ' HG3' ' O ' ' A' ' 521' ' ' TYR . 58.7 ttp -54.29 -34.98 62.09 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 122.987 0.515 . . . . 0.0 112.316 -177.414 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 19.7 ptt-85 -66.83 -17.49 64.91 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -177.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 483' ' ' ASP . . . . . 0.47 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 4.6 m-20 -70.55 41.28 0.06 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 116.505 2.039 . . . . 0.0 116.505 -169.14 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 484' ' ' LYS . . . . . 0.584 ' HD2' ' CD2' ' A' ' 515' ' ' TYR . 30.6 mmtp -60.88 -42.77 98.59 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-O 121.136 0.493 . . . . 0.0 110.983 174.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -60.93 -50.41 73.52 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.093 178.534 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.47 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 59.3 m -58.32 -43.05 88.03 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 123.952 0.901 . . . . 0.0 111.266 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 487' ' ' PHE . . . . . 0.489 ' CE1' ' HB3' ' A' ' 511' ' ' LEU . 82.5 t80 -46.19 -55.35 7.23 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.748 1.219 . . . . 0.0 109.893 175.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 60.0 mt -79.02 -27.36 43.23 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.138 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -67.07 -41.31 86.64 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.82 -38.7 20.9 Favored 'General case' 0 N--CA 1.424 -1.764 0 C-N-CA 120.116 -0.634 . . . . 0.0 109.786 -177.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 28.9 t80 -55.14 -58.2 8.64 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -77.82 -14.38 59.59 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 120.372 -0.531 . . . . 0.0 112.221 -170.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 43.5 m -82.31 -60.99 2.02 Favored 'General case' 0 N--CA 1.425 -1.68 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -173.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 494' ' ' VAL . . . . . 0.412 HG12 ' O ' ' A' ' 495' ' ' ASP . 87.6 t -139.14 134.97 41.71 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 120.353 -0.539 . . . . 0.0 112.125 -167.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 495' ' ' ASP . . . . . 0.412 ' O ' HG12 ' A' ' 494' ' ' VAL . 12.0 m-20 -85.87 158.95 19.82 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 170.85 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.469 ' H ' ' HE3' ' A' ' 496' ' ' LYS . 0.0 OUTLIER -89.23 -90.89 0.13 Allowed 'General case' 0 CA--C 1.5 -0.962 0 C-N-CA 116.459 -2.096 . . . . 0.0 112.152 -167.08 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -106.25 -85.22 0.5 Allowed 'General case' 0 N--CA 1.431 -1.375 0 C-N-CA 114.444 -2.903 . . . . 0.0 113.02 171.059 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -127.79 -50.67 1.36 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.524 1.53 . . . . 0.0 114.991 171.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . 0.357 10.8 p90 -70.57 -93.15 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.831 1 N-CA-C 123.904 4.779 . . . . 0.0 123.904 -149.646 . . . . . . . . 3 2 . 1 . 005 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 11.4 m -93.45 89.7 6.42 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -161.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -127.25 42.02 3.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 117.769 -1.573 . . . . 0.0 114.227 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 502' ' ' GLN . . . . . 0.428 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 1.1 tm0? -90.13 -35.06 15.63 Favored 'General case' 0 CA--C 1.502 -0.902 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 168.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 503' ' ' HIS . . . . . 0.741 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 87.3 m-70 -62.86 -40.64 98.11 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.111 -178.42 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 504' ' ' PHE . . . . . 0.457 ' O ' ' HD2' ' A' ' 508' ' ' PHE . 37.2 m-85 -63.85 -40.78 97.37 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.169 175.366 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.428 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 54.2 tttp -58.77 -50.36 74.21 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 123.688 0.795 . . . . 0.0 109.7 -175.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.741 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.279 9.8 p90 -65.02 -36.62 84.98 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 118.261 -1.375 . . . . 0.0 113.265 178.997 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.85 -48.75 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 120.311 -0.555 . . . . 0.0 109.802 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 508' ' ' PHE . . . . . 0.457 ' HD2' ' O ' ' A' ' 504' ' ' PHE . 32.3 m-85 -51.79 -39.39 58.57 Favored 'General case' 0 CA--C 1.499 -0.998 0 O-C-N 123.826 0.704 . . . . 0.0 112.637 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -58.39 -61.17 2.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.747 0.654 . . . . 0.0 109.512 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 506' ' ' TYR . 32.0 t -58.29 -48.94 83.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.389 -176.778 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.489 ' HB3' ' CE1' ' A' ' 487' ' ' PHE . 2.9 tt -68.61 -40.83 80.23 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.802 -172.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -70.09 -35.11 73.94 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.89 -49.16 77.33 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.172 0.589 . . . . 0.0 110.427 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -63.45 -44.13 95.38 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.952 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 515' ' ' TYR . . . . . 0.584 ' CD2' ' HD2' ' A' ' 484' ' ' LYS . 0.7 OUTLIER -52.98 -42.32 65.43 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 124.142 0.977 . . . . 0.0 109.773 179.641 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.84 -21.34 63.38 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -116.03 -53.85 2.53 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-O 121.87 0.843 . . . . 0.0 112.198 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 518' ' ' ASN . . . . . 0.566 ' CG ' ' H ' ' A' ' 519' ' ' ASP . 22.8 t-20 -101.88 -152.36 0.44 Allowed 'General case' 0 C--N 1.281 -2.38 0 CA-C-N 114.161 -1.381 . . . . 0.0 110.248 -169.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 519' ' ' ASP . . . . . 0.566 ' H ' ' CG ' ' A' ' 518' ' ' ASN . 29.1 t70 -106.17 -158.15 0.64 Allowed 'General case' 0 C--N 1.272 -2.78 0 C-N-CA 128.505 2.722 . . . . 0.0 105.664 -170.619 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 520' ' ' GLN . . . . . 0.568 ' HA ' ' HE3' ' A' ' 484' ' ' LYS 0.412 3.5 pm0 -62.95 155.08 28.38 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 120.501 1.501 . . . . 0.0 112.71 178.25 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 521' ' ' TYR . . . . . 0.567 ' O ' ' HG3' ' A' ' 481' ' ' MET . 0.3 OUTLIER -84.06 131.46 34.8 Favored 'General case' 0 N--CA 1.397 -3.101 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -167.006 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -72.38 146.51 46.99 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.014 -178.451 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 523' ' ' ILE . . . . . 0.46 ' HB ' ' OE2' ' A' ' 543' ' ' GLU . 39.1 pt -84.29 -12.02 11.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.489 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 35.7 t -56.84 -38.54 72.8 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.869 175.644 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -64.62 -34.45 78.3 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.53 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -61.95 -39.6 92.66 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.114 176.802 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 56.5 t -71.17 -37.22 65.65 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.115 0 C-N-CA 124.083 0.953 . . . . 0.0 108.729 177.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 528' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.2 mm100 -67.3 -10.48 51.3 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 122.711 0.405 . . . . 0.0 111.119 178.146 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.53 ' HB2' ' O ' ' A' ' 526' ' ' ALA . 4.9 m-85 -71.13 -0.02 8.72 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.645 168.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.53 ' HA ' ' CB ' ' A' ' 536' ' ' ARG . 6.3 p -73.03 15.27 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.642 0 CA-C-O 122.288 1.042 . . . . 0.0 110.469 174.31 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 531' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 529' ' ' TYR . 5.9 t30 -97.12 -24.8 15.58 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 174.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 31.8 t -91.75 141.68 28.41 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 114.963 -1.017 . . . . 0.0 108.785 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -65.86 -51.04 62.17 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -175.116 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -94.95 -37.83 10.97 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.145 0.498 . . . . 0.0 111.204 -177.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.412 HD22 ' OH ' ' A' ' 506' ' ' TYR . 45.8 mt -66.32 -21.49 66.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.708 -174.135 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.53 ' CB ' ' HA ' ' A' ' 530' ' ' VAL . 36.3 ptt180 -63.47 -46.42 86.29 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.21 -49.85 75.47 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.525 -178.061 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 541' ' ' SER . 5.7 m -61.01 -54.52 43.95 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -178.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . 0.31 4.2 mm? -65.28 -35.62 81.58 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -177.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 72.1 mt -72.0 -29.64 33.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.91 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 541' ' ' SER . . . . . 0.447 ' HB2' ' O ' ' A' ' 538' ' ' THR . 73.3 m -57.41 -40.76 78.99 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.669 0.747 . . . . 0.0 109.544 168.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 475' ' ' ALA . 3.3 mm? -74.67 -13.08 60.58 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 174.054 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 543' ' ' GLU . . . . . 0.46 ' OE2' ' HB ' ' A' ' 523' ' ' ILE . 53.9 mm-40 -80.47 -40.75 25.63 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.246 0.546 . . . . 0.0 111.146 174.75 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -77.58 27.36 0.17 Allowed 'General case' 0 CA--C 1.557 1.224 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -176.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -67.84 163.7 21.31 Favored 'General case' 0 C--O 1.242 0.705 0 O-C-N 122.237 -0.289 . . . . 0.0 110.688 177.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -93.1 155.02 17.76 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.876 -0.329 . . . . 0.0 111.307 -177.1 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 88.2 mt -77.47 22.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.431 1.092 . . . . 0.0 111.952 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 548' ' ' ASN . . . . . 0.452 ' C ' ' H ' ' A' ' 550' ' ' GLU . 2.6 t-20 -79.8 21.32 0.55 Allowed 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 122.082 0.944 . . . . 0.0 110.183 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -70.08 9.65 0.53 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 125.601 1.56 . . . . 0.0 111.626 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.452 ' H ' ' C ' ' A' ' 548' ' ' ASN . 34.9 mt-10 -54.9 154.66 9.33 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 125.917 1.687 . . . . 0.0 111.873 -175.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -71.83 45.16 0.7 Allowed 'Trans proline' 0 N--CA 1.503 2.033 0 C-N-CA 124.666 3.577 . . . . 0.0 112.807 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -134.92 50.49 2.16 Favored 'General case' 0 C--N 1.282 -2.334 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 178.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -56.66 67.35 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 117.153 2.279 . . . . 0.0 117.153 -169.679 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 554' ' ' ASN . . . . . 0.455 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 7.6 t30 -70.65 -22.08 62.54 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.919 1.287 . . . . 0.0 107.786 171.275 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -44.93 -54.53 6.39 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.537 1.535 . . . . 0.0 110.029 177.043 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 54.6 mt -62.7 -38.86 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.396 0.678 . . . . 0.0 110.284 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 557' ' ' ASP . . . . . 0.455 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 3.2 t70 -56.57 -51.25 69.32 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 121.071 0.462 . . . . 0.0 110.611 177.416 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 558' ' ' ASP . . . . . 0.501 ' O ' HG23 ' A' ' 562' ' ' VAL . 29.6 t70 -67.13 -47.41 71.17 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.999 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 559' ' ' TYR . . . . . 0.409 ' O ' HD13 ' A' ' 563' ' ' ILE . 77.6 t80 -51.99 -53.37 42.48 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.998 1.319 . . . . 0.0 111.456 179.322 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.28 -44.24 95.26 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.679 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 9.3 t30 -63.09 -36.33 83.22 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 122.774 0.43 . . . . 0.0 112.143 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 562' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 558' ' ' ASP . 89.7 t -70.97 -50.3 43.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-O 121.591 0.71 . . . . 0.0 111.493 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.54 ' O ' ' HG3' ' A' ' 566' ' ' LYS . 1.7 mp -80.7 -55.5 8.34 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.882 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.465 -168.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -74.57 1.09 12.88 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 122.091 0.948 . . . . 0.0 111.041 -173.265 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 45.2 tt0 -67.2 -14.71 63.17 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 169.169 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 566' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 563' ' ' ILE . 0.1 OUTLIER -58.11 -18.4 24.83 Favored 'General case' 0 C--N 1.357 0.931 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.781 173.547 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . 119.31 123.29 3.15 Favored Glycine 0 N--CA 1.426 -1.967 0 C-N-CA 120.169 -1.015 . . . . 0.0 113.112 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -164.74 -86.2 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 173.905 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -107.71 -173.08 2.2 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.799 -0.182 . . . . 0.0 110.664 -177.911 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 570' ' ' THR . . . . . 0.459 ' O ' ' HG ' ' A' ' 574' ' ' LEU . 42.5 m -88.96 161.59 16.54 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -178.658 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.703 ' HA ' HD12 ' A' ' 574' ' ' LEU . 18.4 tt -53.65 -38.12 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.086 0 C-N-CA 123.695 0.798 . . . . 0.0 112.879 -179.465 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 572' ' ' GLU . . . . . 0.412 ' HA ' ' OD1' ' A' ' 575' ' ' ASN . 35.9 mt-10 -75.04 -32.51 61.57 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.611 0.72 . . . . 0.0 110.318 -176.419 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 9.7 m -66.1 -39.48 90.01 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 176.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.703 HD12 ' HA ' ' A' ' 571' ' ' ILE . 59.0 mt -58.97 -43.39 91.33 Favored 'General case' 0 C--O 1.205 -1.269 0 CA-C-N 115.034 -0.985 . . . . 0.0 109.153 175.443 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 575' ' ' ASN . . . . . 0.412 ' OD1' ' HA ' ' A' ' 572' ' ' GLU . 13.8 m120 -51.93 -48.72 64.1 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.806 0.691 . . . . 0.0 111.496 -177.819 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -63.32 -40.66 97.93 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.933 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -66.85 -41.96 86.51 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.301 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 574' ' ' LEU . 88.2 mt -54.99 -57.26 12.39 Favored 'General case' 0 CA--C 1.482 -1.647 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.515 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.642 ' CB ' ' HB3' ' A' ' 593' ' ' TYR . 0.2 OUTLIER -62.39 -25.73 68.09 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.719 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 580' ' ' GLU . . . . . 0.489 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 34.3 tt0 -68.9 -39.53 79.68 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 175.169 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -65.84 -47.87 73.53 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.103 0.478 . . . . 0.0 110.502 174.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.417 ' C ' ' H ' ' A' ' 584' ' ' ILE . 14.3 m -60.9 -25.53 66.8 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.822 1.249 . . . . 0.0 112.041 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.489 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 6.6 tpm_? -48.11 -6.99 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.757 0 C-N-CA 126.437 1.895 . . . . 0.0 113.102 174.982 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.417 ' H ' ' C ' ' A' ' 582' ' ' THR . 16.4 tt -70.16 -18.19 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 123.612 0.765 . . . . 0.0 111.887 -177.329 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 127.54 16.48 2.28 Favored Glycine 0 CA--C 1.533 1.177 0 N-CA-C 118.879 2.312 . . . . 0.0 118.879 171.302 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -85.08 109.08 17.98 Favored 'General case' 0 C--O 1.2 -1.534 0 CA-C-N 119.879 1.839 . . . . 0.0 107.231 170.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.1 p -53.87 -43.24 56.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -171.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -66.95 -55.76 13.17 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-O 121.096 0.474 . . . . 0.0 110.568 -176.226 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -69.54 -34.2 73.87 Favored 'General case' 0 C--O 1.198 -1.649 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.661 -178.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 590' ' ' GLN . . . . . 0.585 ' O ' ' HG ' ' A' ' 594' ' ' LEU . 29.5 tt0 -58.5 -47.79 82.95 Favored 'General case' 0 C--O 1.198 -1.637 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 591' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -62.76 -46.09 89.64 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.527 0.68 . . . . 0.0 109.798 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 592' ' ' TYR . . . . . 0.662 ' O ' ' HB2' ' A' ' 595' ' ' GLN . 73.6 t80 -56.58 -50.5 71.75 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 124.042 1.877 . . . . 0.0 108.821 176.23 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 593' ' ' TYR . . . . . 0.642 ' HB3' ' CB ' ' A' ' 579' ' ' ARG 0.307 18.6 m-85 -67.19 -27.69 67.48 Favored 'General case' 0 C--N 1.247 -3.88 0 N-CA-C 114.471 1.285 . . . . 0.0 114.471 177.888 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.625 ' O ' ' HB ' ' A' ' 597' ' ' ILE 0.315 12.1 mt -69.3 -19.85 63.9 Favored 'General case' 0 C--N 1.293 -1.86 0 O-C-N 120.118 -1.614 . . . . 0.0 111.937 174.313 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.662 ' HB2' ' O ' ' A' ' 592' ' ' TYR 0.289 50.6 mt-30 -61.68 -40.91 96.64 Favored 'General case' 0 CA--C 1.482 -1.671 0 N-CA-C 107.667 -1.235 . . . . 0.0 107.667 164.763 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 596' ' ' GLN . . . . . 0.424 ' HA ' ' HB3' ' A' ' 599' ' ' ALA . 2.3 mp0 -63.95 -16.49 61.63 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.026 174.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.625 ' HB ' ' O ' ' A' ' 594' ' ' LEU . 48.2 mt -60.5 -46.86 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.523 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 164.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 598' ' ' VAL . . . . . 0.431 ' HB ' ' O ' ' A' ' 595' ' ' GLN . 59.0 t -62.38 -35.41 69.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.72 175.582 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.699 ' O ' ' HG2' ' A' ' 602' ' ' LYS . . . -64.42 -29.8 70.85 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.091 0.472 . . . . 0.0 111.211 173.743 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -66.44 -36.21 82.23 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 174.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -68.88 -36.39 78.01 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.754 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.699 ' HG2' ' O ' ' A' ' 599' ' ' ALA . 51.5 pttt -69.31 -27.19 65.17 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.093 0.473 . . . . 0.0 109.797 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -75.08 -39.96 60.41 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.721 0.772 . . . . 0.0 109.172 175.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -73.07 -35.24 66.62 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.355 -178.361 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 21.4 ttt . . . . . 0 C--N 1.291 -1.949 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 -177.173 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 1.8 p90 . . . . . 0 N--CA 1.429 -1.502 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -82.51 146.55 29.17 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 175.707 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -92.71 46.51 1.24 Allowed 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.199 1.0 . . . . 0.0 110.531 -177.276 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 91.5 mt -66.83 102.73 0.99 Allowed 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 113.995 -1.457 . . . . 0.0 111.505 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 41.0 t -109.53 104.16 13.17 Favored 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 173.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -70.81 -29.13 65.22 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.551 -0.46 . . . . 0.0 112.2 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -67.65 -54.3 20.77 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.057 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.624 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 32.0 tt0 -63.48 -36.67 84.51 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -58.18 -42.43 86.06 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.483 177.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -65.65 -43.43 89.42 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.089 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.72 -44.5 93.7 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.457 0.703 . . . . 0.0 110.924 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.624 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 92.4 mtt180 -53.46 -54.27 39.4 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.296 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 475' ' ' ALA . . . . . 0.438 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -69.56 -43.47 72.83 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 124.146 0.903 . . . . 0.0 112.265 -178.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -55.12 -36.65 65.95 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.019 0.927 . . . . 0.0 111.727 -176.041 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.494 HD11 HG11 ' A' ' 507' ' ' VAL . 1.2 tm? -57.38 -31.34 65.7 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 113.866 -1.516 . . . . 0.0 111.277 -176.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.477 ' HD3' ' O ' ' A' ' 542' ' ' LEU . 12.4 pttt -71.65 -19.87 62.03 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -172.61 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.4 ' N ' ' HG3' ' A' ' 478' ' ' LYS . 9.0 t-160 -119.92 9.09 11.18 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 118.239 -1.384 . . . . 0.0 112.832 -171.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.498 ' HB2' HG23 ' A' ' 486' ' ' THR 0.264 1.1 pp -91.58 72.07 5.91 Favored 'General case' 0 C--O 1.194 -1.83 0 CA-C-O 122.739 1.256 . . . . 0.0 110.982 175.812 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -98.67 9.45 43.29 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 482' ' ' ARG . . . . . 0.651 ' O ' ' HG2' ' A' ' 520' ' ' GLN . 97.7 mtt180 -66.56 -97.8 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 119.946 1.248 . . . . 0.0 114.282 -171.16 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . 0.278 1.1 p30 -143.64 -84.87 0.15 Allowed 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.034 2.235 . . . . 0.0 117.034 168.354 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt -95.43 -41.3 9.05 Favored 'General case' 0 CA--C 1.485 -1.551 0 CA-C-O 121.893 0.854 . . . . 0.0 109.414 -178.382 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 485' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 489' ' ' ASN . 9.7 p-10 -51.1 -38.4 51.6 Favored 'General case' 0 C--O 1.173 -2.965 0 CA-C-N 112.683 -2.053 . . . . 0.0 109.211 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.498 HG23 ' HB2' ' A' ' 480' ' ' LEU . 3.1 m -59.05 -51.44 70.03 Favored 'General case' 0 N--CA 1.419 -1.98 0 C-N-CA 125.907 1.683 . . . . 0.0 113.343 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -66.13 -44.72 83.44 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -174.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 59.4 mt -76.33 -21.75 55.8 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.356 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 489' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 485' ' ' ASP . 57.7 t30 -65.6 -40.39 92.59 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 123.008 0.523 . . . . 0.0 109.97 -177.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -83.96 -54.31 4.96 Favored 'General case' 0 N--CA 1.425 -1.704 0 C-N-CA 119.19 -1.004 . . . . 0.0 109.749 175.844 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -58.92 -35.96 73.96 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -171.397 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -83.23 -23.14 32.89 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 121.347 0.594 . . . . 0.0 111.347 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 15.8 m -83.98 -41.67 17.06 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -175.049 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 40.0 t -101.87 161.73 3.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.361 -173.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.81 101.95 14.7 Favored 'General case' 0 CA--C 1.495 -1.169 0 CA-C-O 121.1 0.476 . . . . 0.0 111.352 177.404 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -57.99 -36.81 73.16 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.929 -176.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -73.74 -28.35 61.65 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -83.36 -56.64 3.64 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 121.744 0.783 . . . . 0.0 109.113 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -77.57 11.64 1.96 Allowed 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -174.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 5.1 m -52.5 99.88 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.753 0.787 . . . . 0.0 111.896 -173.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.492 ' HB3' ' CD2' ' A' ' 504' ' ' PHE . 23.2 t-20 -119.3 154.76 33.01 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 178.569 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 47.5 tp60 -58.99 -31.8 69.1 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 123.715 0.806 . . . . 0.0 110.312 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -59.01 -53.96 52.46 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 124.181 0.992 . . . . 0.0 108.685 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 504' ' ' PHE . . . . . 0.492 ' CD2' ' HB3' ' A' ' 501' ' ' ASN . 22.0 m-85 -66.42 -35.1 79.47 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.425 -178.209 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -64.36 -49.34 72.01 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 123.199 0.599 . . . . 0.0 110.269 -176.83 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.53 ' O ' HG23 ' A' ' 510' ' ' VAL . 9.2 m-85 -60.09 -54.87 40.81 Favored 'General case' 0 N--CA 1.439 -0.991 0 O-C-N 123.855 0.722 . . . . 0.0 111.953 178.477 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 507' ' ' VAL . . . . . 0.494 HG11 HD11 ' A' ' 477' ' ' LEU . 54.5 t -60.48 -48.04 90.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.349 -176.961 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -49.69 -50.31 44.19 Favored 'General case' 0 C--O 1.218 -0.567 0 O-C-N 123.568 0.543 . . . . 0.0 111.117 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -63.46 -53.73 47.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 506' ' ' TYR . 42.8 t -57.96 -45.95 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 121.217 0.532 . . . . 0.0 110.407 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 507' ' ' VAL . 0.4 OUTLIER -66.4 -48.66 69.36 Favored 'General case' 0 N--CA 1.419 -2.001 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.976 -176.352 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -60.01 -42.96 95.45 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.152 0.581 . . . . 0.0 110.651 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -71.15 -43.34 67.73 Favored 'General case' 0 C--N 1.313 -0.991 0 O-C-N 123.405 0.441 . . . . 0.0 112.179 -173.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 514' ' ' PHE . . . . . 0.412 ' HA ' ' HG2' ' A' ' 517' ' ' GLU . 65.1 m-85 -73.92 -42.16 61.02 Favored 'General case' 0 C--O 1.199 -1.605 0 C-N-CA 119.289 -0.964 . . . . 0.0 111.607 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -54.74 -32.06 59.24 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.454 0.701 . . . . 0.0 110.311 176.702 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -70.23 -24.37 63.08 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.409 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.412 ' HG2' ' HA ' ' A' ' 514' ' ' PHE . 10.0 pt-20 -110.03 -44.05 3.86 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -176.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 518' ' ' ASN . . . . . 0.408 ' HB3' ' H ' ' A' ' 519' ' ' ASP . 92.1 m-20 -135.38 -152.16 0.45 Allowed 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 124.355 1.062 . . . . 0.0 109.592 -172.622 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 519' ' ' ASP . . . . . 0.408 ' H ' ' HB3' ' A' ' 518' ' ' ASN . 3.4 p-10 -79.32 -164.54 0.64 Allowed 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 125.093 1.357 . . . . 0.0 111.683 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 520' ' ' GLN . . . . . 0.651 ' HG2' ' O ' ' A' ' 482' ' ' ARG . 0.0 OUTLIER -73.78 -178.79 3.33 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 115.933 1.827 . . . . 0.0 115.933 -171.227 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 521' ' ' TYR . . . . . 0.433 ' CB ' ' HG ' ' A' ' 511' ' ' LEU . 12.0 t80 -103.21 138.03 40.56 Favored 'General case' 1 N--CA 1.362 -4.863 0 C-N-CA 125.384 1.473 . . . . 0.0 107.49 -177.321 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -118.99 167.79 11.42 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.6 pp -70.36 -8.63 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 121.512 0.672 . . . . 0.0 110.726 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 12.8 m -56.19 -40.47 74.01 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.787 173.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -71.41 -40.51 70.42 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -59.29 -48.11 82.86 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.878 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.672 ' O ' HG12 ' A' ' 530' ' ' VAL . 10.3 p -67.65 -28.55 42.19 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.854 0 CA-C-O 121.314 0.578 . . . . 0.0 110.71 177.463 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -70.7 -20.77 62.64 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.6 ' O ' ' HG2' ' A' ' 536' ' ' ARG . 2.0 m-85 -74.57 -23.41 58.76 Favored 'General case' 0 CA--C 1.494 -1.184 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.672 HG12 ' O ' ' A' ' 527' ' ' VAL . 10.0 p -74.03 52.57 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.898 0 CA-C-O 123.226 1.488 . . . . 0.0 114.839 -171.932 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -107.64 -34.14 7.09 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 173.483 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.54 144.79 25.43 Favored 'General case' 0 N--CA 1.424 -1.737 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 171.198 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . 0.257 7.2 p30 -76.34 -69.0 0.53 Allowed 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 -168.339 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 534' ' ' GLU . . . . . 0.401 ' CD ' ' H ' ' A' ' 535' ' ' LEU 0.258 0.0 OUTLIER -50.24 -73.16 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 117.479 2.4 . . . . 0.0 117.479 -164.911 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.401 ' H ' ' CD ' ' A' ' 534' ' ' GLU . 58.8 tp -71.91 -31.98 66.94 Favored 'General case' 0 C--N 1.28 -2.453 0 CA-C-O 121.646 0.736 . . . . 0.0 111.236 -172.075 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 529' ' ' TYR . 8.2 mpt_? -75.02 -44.0 50.48 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.34 -173.741 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -60.73 -40.21 91.5 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.31 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.465 ' O ' HD13 ' A' ' 542' ' ' LEU . 57.2 m -54.38 -49.14 70.56 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.908 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 539' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 539' ' ' LEU . 4.1 mm? -59.17 -38.24 79.29 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 49.9 mm -68.29 -40.67 82.93 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 35.2 t -58.47 -45.46 88.61 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.696 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.477 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 6.8 mp -64.78 -30.08 71.07 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.959 177.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 543' ' ' GLU . . . . . 0.457 ' HA ' ' CD ' ' A' ' 478' ' ' LYS . 0.2 OUTLIER -76.29 -34.4 59.09 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 177.893 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -62.67 -36.11 81.83 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.374 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -67.67 113.39 5.42 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 172.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -134.52 103.08 5.54 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-O 121.962 0.887 . . . . 0.0 111.929 -178.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.427 ' HG ' ' ND2' ' A' ' 554' ' ' ASN . 40.8 tp -91.85 -12.54 33.36 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.591 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -70.1 18.94 0.05 OUTLIER 'General case' 0 CA--C 1.559 1.31 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 -173.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -68.76 -31.39 70.39 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.65 0.738 . . . . 0.0 112.11 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.483 ' HB2' ' HD2' ' A' ' 551' ' ' PRO . 12.5 pt-20 -95.71 -178.97 0.84 Allowed Pre-proline 0 C--N 1.3 -1.582 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 551' ' ' PRO . . . . . 0.483 ' HD2' ' HB2' ' A' ' 550' ' ' GLU . 83.9 Cg_exo -47.6 137.85 19.89 Favored 'Trans proline' 0 C--N 1.386 2.527 0 C-N-CA 121.811 1.674 . . . . 0.0 110.299 175.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -74.01 4.73 5.04 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 121.908 0.861 . . . . 0.0 112.866 -167.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 553' ' ' GLU . . . . . 0.473 ' HA ' HG12 ' A' ' 556' ' ' ILE . 1.9 mp0 -74.94 -12.6 60.39 Favored 'General case' 0 N--CA 1.408 -2.565 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.859 176.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 554' ' ' ASN . . . . . 0.427 ' ND2' ' HG ' ' A' ' 547' ' ' LEU . 28.0 p-10 -69.75 -24.4 63.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -80.34 -56.38 4.24 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -177.304 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 556' ' ' ILE . . . . . 0.473 HG12 ' HA ' ' A' ' 553' ' ' GLU . 34.0 pt -64.69 -38.24 82.16 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.87 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 557' ' ' ASP . . . . . 0.527 ' HA ' HH21 ' A' ' 579' ' ' ARG . 36.2 t70 -63.94 -45.08 90.77 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -65.37 -45.78 82.73 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -56.22 -52.58 63.92 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 113.985 -1.461 . . . . 0.0 111.291 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 560' ' ' VAL . . . . . 0.477 HG13 ' CE1' ' A' ' 576' ' ' HIS . 13.2 p -65.94 -36.01 76.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.353 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.515 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 27.3 t-20 -62.55 -32.73 73.73 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.349 0.595 . . . . 0.0 110.232 176.529 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 70.2 t -77.35 -56.94 6.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 CA-C-N 115.553 -0.748 . . . . 0.0 112.522 175.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 563' ' ' ILE . . . . . . . . . . . . . 50.7 mm -74.77 -49.74 28.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.418 -169.301 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -80.78 -3.29 50.45 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.575 -174.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 29.4 tt0 -64.11 -32.75 74.43 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 168.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -103.22 30.0 5.18 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.046 174.754 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -125.59 -84.01 0.54 Allowed Glycine 0 N--CA 1.423 -2.208 0 C-N-CA 120.202 -0.999 . . . . 0.0 114.04 -174.795 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -139.89 -3.79 1.42 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -171.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -86.92 122.45 30.79 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 118.47 -1.292 . . . . 0.0 114.346 -172.537 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 7.5 t -137.9 -53.98 0.65 Allowed 'General case' 0 CA--C 1.561 1.375 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.704 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 11.5 tt -90.8 -38.34 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 CA-C-O 122.419 1.105 . . . . 0.0 108.358 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 572' ' ' GLU . . . . . 0.435 ' H ' ' CD ' ' A' ' 572' ' ' GLU . 0.7 OUTLIER -74.95 -20.13 59.81 Favored 'General case' 0 C--O 1.196 -1.736 0 CA-C-N 114.038 -1.437 . . . . 0.0 111.243 179.501 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 66.9 p -63.63 -31.34 72.48 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 69.6 mt -63.15 -55.25 26.8 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.142 -0.935 . . . . 0.0 108.785 175.056 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 575' ' ' ASN . . . . . 0.49 ' HB3' ' HA ' ' A' ' 598' ' ' VAL . 0.8 OUTLIER -62.84 -35.11 78.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.251 179.554 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 576' ' ' HIS . . . . . 0.477 ' CE1' HG13 ' A' ' 560' ' ' VAL . 20.9 t-160 -63.47 -34.94 78.86 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.259 176.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -60.52 -45.59 93.27 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 176.998 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 9.6 mp -54.85 -41.93 71.36 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.779 172.417 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.714 ' O ' ' HB ' ' A' ' 582' ' ' THR . 14.1 ttt180 -63.18 -31.71 72.92 Favored 'General case' 0 CA--C 1.56 1.344 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 174.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -66.16 -45.11 82.1 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 175.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -63.37 -22.06 66.65 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-O 121.833 0.825 . . . . 0.0 110.643 174.776 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.714 ' HB ' ' O ' ' A' ' 579' ' ' ARG . 16.3 m -67.8 -36.99 81.42 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 124.167 0.987 . . . . 0.0 111.124 176.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 583' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -56.68 -7.34 0.42 Allowed 'General case' 0 CA--C 1.57 1.732 0 C-N-CA 125.413 1.485 . . . . 0.0 113.66 -178.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 14.5 tt -72.25 -24.25 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 O-C-N 121.219 -0.925 . . . . 0.0 110.858 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 119.76 -56.5 0.59 Allowed Glycine 0 CA--C 1.524 0.621 0 N-CA-C 117.859 1.904 . . . . 0.0 117.859 169.312 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 586' ' ' ASP . . . . . 0.445 ' HA ' ' HG2' ' A' ' 588' ' ' GLU . 13.0 t70 -143.94 59.06 1.36 Allowed 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 119.712 1.756 . . . . 0.0 113.765 -172.163 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.624 HG12 ' HB2' ' A' ' 590' ' ' GLN . 2.4 t -94.36 17.59 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 164.65 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.492 ' HA ' ' HB3' ' A' ' 591' ' ' LYS . 10.1 mm-40 -33.31 -35.63 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 129.016 2.926 . . . . 0.0 118.804 -158.416 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 6.4 tt -68.73 -61.68 1.71 Allowed 'General case' 0 C--N 1.283 -2.319 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 590' ' ' GLN . . . . . 0.624 ' HB2' HG12 ' A' ' 587' ' ' VAL . 81.6 mm-40 -57.58 -44.38 85.28 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 113.803 -1.544 . . . . 0.0 109.419 176.479 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.546 ' HD3' ' HA ' ' A' ' 582' ' ' THR . 0.3 OUTLIER -60.06 -42.99 95.68 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 114.022 -1.445 . . . . 0.0 110.028 -175.483 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 85.5 t80 -53.7 -54.39 38.57 Favored 'General case' 0 CA--C 1.504 -0.818 0 O-C-N 124.271 0.982 . . . . 0.0 109.69 177.771 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 593' ' ' TYR . . . . . 0.556 ' O ' HG13 ' A' ' 597' ' ' ILE . 84.5 m-85 -62.92 -45.91 90.25 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.116 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.469 ' O ' ' HB ' ' A' ' 597' ' ' ILE . 88.7 mt -60.9 -50.45 73.35 Favored 'General case' 0 C--O 1.252 1.188 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.512 ' HG3' ' O ' ' A' ' 591' ' ' LYS 0.423 0.0 OUTLIER -70.93 -24.55 62.47 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 119.207 -0.997 . . . . 0.0 113.471 177.955 . . . . . . . . 4 4 . 1 . 006 nuclear build full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -71.63 -25.34 62.11 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 119.351 -0.94 . . . . 0.0 111.048 171.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.556 HG13 ' O ' ' A' ' 593' ' ' TYR . 74.6 mt -59.49 -51.6 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 171.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 598' ' ' VAL . . . . . 0.626 ' O ' ' HG2' ' A' ' 602' ' ' LYS . 12.4 p -65.06 -33.65 65.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.865 176.589 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.474 ' HA ' ' HE3' ' A' ' 602' ' ' LYS . . . -58.02 -43.57 86.82 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.134 0.271 . . . . 0.0 110.572 177.205 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -63.14 -43.25 98.88 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.218 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 601' ' ' ASN . . . . . 0.624 ' O ' ' HB3' ' A' ' 604' ' ' ARG . 22.3 t-20 -66.47 -44.99 81.21 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.195 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.626 ' HG2' ' O ' ' A' ' 598' ' ' VAL . 33.4 pttt -71.86 -29.93 64.9 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 120.026 -0.669 . . . . 0.0 111.656 179.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -73.39 -17.73 61.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.222 0.534 . . . . 0.0 110.052 177.038 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 604' ' ' ARG . . . . . 0.624 ' HB3' ' O ' ' A' ' 601' ' ' ASN . 0.2 OUTLIER -65.53 -19.67 66.02 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.854 0.862 . . . . 0.0 110.221 175.34 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 C--O 1.255 1.365 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.087 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 . . . . . 0 C--O 1.237 0.407 0 CA-C-O 120.923 0.392 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -68.27 138.28 55.38 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.548 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -135.69 85.74 2.18 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 82.1 mt -61.62 111.76 1.96 Allowed 'General case' 0 C--N 1.291 -1.975 0 CA-C-O 121.572 0.701 . . . . 0.0 110.529 178.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.7 m -106.12 -170.71 1.77 Allowed 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.187 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 468' ' ' ARG . . . . . 0.426 ' O ' ' HB3' ' A' ' 471' ' ' LYS . 39.0 ttm180 -58.22 -24.17 58.29 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.199 1.0 . . . . 0.0 111.24 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.535 ' NE2' ' HB2' ' A' ' 566' ' ' LYS . 20.9 mp0 -60.11 -24.84 64.98 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.813 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.423 ' O ' ' HB2' ' A' ' 474' ' ' ARG . 8.3 tm-20 -66.48 -34.71 78.55 Favored 'General case' 0 C--O 1.206 -1.227 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 468' ' ' ARG . 13.3 tmtt? -66.36 -39.64 89.28 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.327 176.659 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 472' ' ' ALA . . . . . 0.4 ' HB2' HG11 ' A' ' 562' ' ' VAL . . . -63.37 -49.3 74.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.839 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 473' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 469' ' ' GLN . 36.6 mt-10 -67.71 -34.55 77.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.853 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 470' ' ' GLU . 37.2 ttp180 -61.08 -45.55 94.26 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 123.987 0.915 . . . . 0.0 109.681 175.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 475' ' ' ALA . . . . . 0.462 ' HA ' HD23 ' A' ' 542' ' ' LEU . . . -68.3 -41.83 80.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.74 -179.643 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -60.03 -51.06 71.25 Favored 'General case' 0 C--O 1.24 0.589 0 O-C-N 123.677 0.611 . . . . 0.0 110.27 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.511 HD21 HG11 ' A' ' 507' ' ' VAL . 1.6 tt -57.8 -38.91 76.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.623 -1.171 . . . . 0.0 111.861 178.366 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.433 ' HB2' HD11 ' A' ' 539' ' ' LEU . 23.7 tptp -82.39 -13.94 56.01 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.714 -175.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.412 ' CE1' ' HB2' ' A' ' 552' ' ' TYR . 6.4 t60 -85.79 -53.86 4.87 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.325 -172.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.597 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 96.0 mt -101.71 107.69 18.99 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 121.766 0.793 . . . . 0.0 112.719 -173.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 53.1 mtt -94.74 -44.0 7.99 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.766 -174.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 482' ' ' ARG . . . . . 0.458 ' HG2' ' OE1' ' A' ' 520' ' ' GLN . 99.2 mtt180 -70.03 -31.14 68.64 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 122.378 1.085 . . . . 0.0 110.848 -179.443 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 483' ' ' ASP . . . . . 0.597 ' HB2' ' HB3' ' A' ' 480' ' ' LEU . 4.7 m-20 -70.63 61.01 0.23 Allowed 'General case' 0 C--N 1.252 -3.653 0 C-N-CA 127.496 2.318 . . . . 0.0 116.83 -170.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 484' ' ' LYS . . . . . 0.565 ' HD3' ' OD2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -39.66 -41.51 1.07 Allowed 'General case' 0 N--CA 1.52 3.06 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 172.329 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -52.21 -52.93 49.32 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.053 0.941 . . . . 0.0 110.77 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.5 ' O ' ' HB3' ' A' ' 490' ' ' TYR . 68.0 m -64.14 -35.79 81.93 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.514 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -51.21 -54.07 29.13 Favored 'General case' 0 C--N 1.349 0.578 0 O-C-N 123.12 0.263 . . . . 0.0 110.634 177.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -78.54 -33.23 48.02 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 119.237 -0.985 . . . . 0.0 112.064 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.37 -32.83 74.02 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.176 0.512 . . . . 0.0 110.743 -176.185 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 490' ' ' TYR . . . . . 0.5 ' HB3' ' O ' ' A' ' 486' ' ' THR . 0.0 OUTLIER -86.59 -45.44 11.04 Favored 'General case' 0 N--CA 1.389 -3.513 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.954 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -56.12 -39.38 72.14 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -70.52 -25.15 62.99 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.505 0.669 . . . . 0.0 110.079 -176.621 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 23.1 m -90.01 -16.59 29.5 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 123.548 0.739 . . . . 0.0 112.641 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 494' ' ' VAL . . . . . 0.495 HG21 ' CE2' ' A' ' 490' ' ' TYR . 79.5 t -117.95 144.7 25.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -166.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 495' ' ' ASP . . . . . 0.517 ' OD2' ' HA ' ' A' ' 500' ' ' THR . 12.7 t70 71.49 -36.75 0.37 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 117.017 2.228 . . . . 0.0 117.017 167.557 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -41.8 -67.52 0.25 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -166.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . 0.264 8.6 m-20 -80.92 -73.22 0.38 Allowed 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 -175.419 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -101.41 -37.05 8.62 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -172.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -76.25 11.14 1.63 Allowed 'General case' 0 CA--C 1.56 1.351 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -173.512 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 500' ' ' THR . . . . . 0.517 ' HA ' ' OD2' ' A' ' 495' ' ' ASP . 25.7 m -53.68 105.74 0.15 Allowed 'General case' 0 C--O 1.249 1.059 0 C-N-CA 124.35 1.06 . . . . 0.0 113.639 -173.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -124.4 125.01 43.57 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 177.606 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -59.86 -9.04 2.53 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -171.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 503' ' ' HIS . . . . . 0.454 ' HB2' HD22 ' A' ' 535' ' ' LEU . 8.8 t-80 -58.97 -49.54 77.49 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 172.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -63.95 -38.16 90.06 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.863 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -63.44 -50.24 70.53 Favored 'General case' 0 CA--C 1.501 -0.914 0 O-C-N 123.612 0.57 . . . . 0.0 109.63 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.448 ' O ' HG23 ' A' ' 510' ' ' VAL . 14.7 m-85 -56.61 -46.01 81.14 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.367 -178.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 507' ' ' VAL . . . . . 0.535 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 21.6 t -73.84 -46.37 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.541 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.844 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -51.72 -43.04 62.69 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 117.956 0.344 . . . . 0.0 111.647 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -57.09 -50.18 73.58 Favored 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 123.922 0.764 . . . . 0.0 109.135 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 506' ' ' TYR . 48.6 t -61.1 -51.12 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.666 175.844 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 95.5 mt -53.04 -51.03 63.06 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.763 -175.301 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -71.36 -32.7 68.81 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.977 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -66.74 -49.91 64.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.888 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 514' ' ' PHE . . . . . 0.416 ' CD2' HG12 ' A' ' 510' ' ' VAL 0.282 1.0 OUTLIER -71.3 -26.53 62.9 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.28 177.312 . . . . . . . . 4 4 . 1 . 007 nuclear build full ' A' A ' 515' ' ' TYR . . . . . 0.653 ' HA ' ' HB3' ' A' ' 519' ' ' ASP . 23.4 t80 -52.16 -41.17 62.37 Favored 'General case' 0 C--N 1.347 0.475 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 175.831 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -72.19 -15.06 61.95 Favored 'General case' 0 CA--C 1.555 1.153 0 CA-C-N 114.189 -1.368 . . . . 0.0 114.015 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -120.92 -57.25 1.89 Allowed 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -172.377 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -153.48 105.28 2.82 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 103.901 -2.629 . . . . 0.0 103.901 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 519' ' ' ASP . . . . . 0.653 ' HB3' ' HA ' ' A' ' 515' ' ' TYR . 8.0 p-10 -106.01 91.35 3.7 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 117.341 2.349 . . . . 0.0 117.341 -165.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 520' ' ' GLN . . . . . 0.458 ' OE1' ' HG2' ' A' ' 482' ' ' ARG . 25.2 mt-30 -145.06 158.45 43.81 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 126.707 2.003 . . . . 0.0 106.389 158.141 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -80.52 124.49 28.99 Favored 'General case' 0 N--CA 1.424 -1.747 0 CA-C-N 119.958 1.253 . . . . 0.0 108.668 176.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -107.68 148.31 29.55 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 42.2 pt -83.14 -14.98 11.75 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 122.951 0.5 . . . . 0.0 111.233 -175.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.617 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 42.4 p -57.16 -41.42 79.18 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.415 0.626 . . . . 0.0 109.501 176.32 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 525' ' ' ASP . . . . . 0.419 ' CG ' HG11 ' A' ' 510' ' ' VAL . 24.5 t70 -58.26 -49.62 76.47 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.17 177.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.404 ' HA ' ' HD2' ' A' ' 536' ' ' ARG . . . -59.83 -49.01 79.38 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.256 -178.311 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.627 ' O ' HG12 ' A' ' 530' ' ' VAL . 7.8 p -65.99 -29.29 46.37 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 528' ' ' GLN . . . . . 0.617 ' HG3' ' O ' ' A' ' 524' ' ' SER . 94.2 mt-30 -67.57 -43.5 80.44 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.751 0.786 . . . . 0.0 109.089 175.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.408 ' HB2' ' HG2' ' A' ' 536' ' ' ARG . 27.4 m-85 -78.59 4.51 13.29 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.627 HG12 ' O ' ' A' ' 527' ' ' VAL . 8.8 p -83.02 -2.4 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.977 -176.424 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -105.06 -15.23 15.15 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.415 1.103 . . . . 0.0 108.544 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 532' ' ' SER . . . . . 0.411 ' C ' ' H ' ' A' ' 534' ' ' GLU . 37.0 t -95.99 -143.16 0.27 Allowed 'General case' 0 C--N 1.296 -1.754 0 C-N-CA 127.574 2.35 . . . . 0.0 108.821 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 533' ' ' ASN . . . . . 0.49 ' O ' ' N ' ' A' ' 535' ' ' LEU . 7.8 p30 -29.97 30.05 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.363 1 C-N-CA 137.252 6.221 . . . . 0.0 116.916 171.515 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 534' ' ' GLU . . . . . 0.424 ' C ' ' H ' ' A' ' 537' ' ' GLU . 10.0 pt-20 -30.83 10.67 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.708 1 C-N-CA 133.034 4.534 . . . . 0.0 117.962 -173.963 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.524 ' H ' HD12 ' A' ' 535' ' ' LEU . 4.3 mp -69.41 -23.92 63.78 Favored 'General case' 0 C--N 1.278 -2.514 0 N-CA-C 102.566 -3.124 . . . . 0.0 102.566 160.346 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.471 ' O ' HG12 ' A' ' 540' ' ' ILE . 5.6 tpp180 -68.24 -29.44 68.25 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 112.214 -2.266 . . . . 0.0 110.274 171.806 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 537' ' ' GLU . . . . . 0.424 ' H ' ' C ' ' A' ' 534' ' ' GLU . 2.2 tm-20 -71.77 -40.14 69.49 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 -178.707 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.412 ' O ' ' HB2' ' A' ' 541' ' ' SER . 24.4 m -58.69 -43.4 89.96 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 170.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 539' ' ' LEU . . . . . 0.433 HD11 ' HB2' ' A' ' 478' ' ' LYS . 22.6 tp -59.72 -36.5 76.68 Favored 'General case' 0 CA--C 1.56 1.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.762 177.327 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 540' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 536' ' ' ARG . 35.3 mm -64.03 -37.96 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.506 0.722 . . . . 0.0 109.974 176.085 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 541' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 538' ' ' THR . 21.5 m -56.81 -39.11 73.55 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 121.122 0.487 . . . . 0.0 110.22 174.17 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' A' ' 475' ' ' ALA . 9.5 mp -66.51 -30.31 70.6 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.408 175.046 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -65.04 -45.13 86.7 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 175.812 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 47.1 tt0 -75.59 45.99 0.34 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.195 174.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -50.86 136.57 22.22 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 125.024 1.33 . . . . 0.0 110.084 -177.003 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 546' ' ' ASN . . . . . 0.424 ' C ' ' H ' ' A' ' 548' ' ' ASN . 12.2 t30 -83.75 179.67 7.53 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.942 -172.335 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.492 ' C ' ' H ' ' A' ' 549' ' ' ASP . 3.1 mm? -70.01 23.63 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.317 1.847 . . . . 0.0 113.851 -174.144 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 548' ' ' ASN . . . . . 0.424 ' H ' ' C ' ' A' ' 546' ' ' ASN . 17.4 m120 -75.45 24.75 0.11 Allowed 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 127.095 2.158 . . . . 0.0 110.208 174.563 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 549' ' ' ASP . . . . . 0.492 ' H ' ' C ' ' A' ' 547' ' ' LEU . 11.0 m-20 -58.88 32.72 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 127.97 2.508 . . . . 0.0 117.493 -172.276 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -74.68 160.05 81.86 Favored Pre-proline 0 C--N 1.3 -1.563 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -37.4 130.36 0.66 Allowed 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 123.562 2.841 . . . . 0.0 111.233 178.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 552' ' ' TYR . . . . . 0.412 ' HB2' ' CE1' ' A' ' 479' ' ' HIS . 31.3 p90 -73.37 -6.98 49.68 Favored 'General case' 0 CA--C 1.495 -1.155 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -167.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 59.0 mp0 -71.36 -1.08 11.73 Favored 'General case' 0 C--N 1.291 -1.944 0 C-N-CA 124.256 1.023 . . . . 0.0 111.527 174.798 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -62.73 -21.57 65.9 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 123.827 0.851 . . . . 0.0 108.887 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 555' ' ' GLU . . . . . 0.476 ' HG3' HG13 ' A' ' 556' ' ' ILE . 13.5 pt-20 -48.27 -62.96 1.22 Allowed 'General case' 0 C--O 1.215 -0.763 0 C-N-CA 124.58 1.152 . . . . 0.0 113.93 -177.207 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 556' ' ' ILE . . . . . 0.476 HG13 ' HG3' ' A' ' 555' ' ' GLU . 16.8 mt -66.39 -36.78 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-O 120.87 0.367 . . . . 0.0 110.14 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 557' ' ' ASP . . . . . 0.47 ' HA ' ' NH2' ' A' ' 579' ' ' ARG . 9.9 t70 -56.98 -52.02 66.89 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.787 177.417 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 558' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 562' ' ' VAL . 32.8 t70 -66.94 -49.97 63.82 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.278 178.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -49.75 -53.57 24.18 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.17 1.788 . . . . 0.0 111.655 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 65.4 t -63.21 -47.93 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.625 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -60.14 -41.61 93.07 Favored 'General case' 0 C--O 1.201 -1.458 0 O-C-N 123.069 0.231 . . . . 0.0 111.275 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 562' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 558' ' ' ASP . 69.9 t -62.74 -37.3 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-O 121.403 0.62 . . . . 0.0 111.708 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.458 ' HA ' ' CG ' ' A' ' 469' ' ' GLN . 54.6 mt -87.24 -39.8 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.916 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.306 -173.505 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 564' ' ' ASN . . . . . 0.431 ' OD1' ' HA ' ' A' ' 572' ' ' GLU . 22.4 t-20 -81.93 -14.98 55.34 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.01 -174.337 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -71.95 -13.06 61.53 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.47 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 566' ' ' LYS . . . . . 0.535 ' HB2' ' NE2' ' A' ' 469' ' ' GLN . 63.0 tttm -60.76 -23.02 64.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.612 176.246 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 567' ' ' GLY . . . . . 0.522 ' HA3' ' HB ' ' A' ' 571' ' ' ILE . . . -89.8 1.61 81.19 Favored Glycine 0 N--CA 1.433 -1.542 0 C-N-CA 120.826 -0.702 . . . . 0.0 113.037 -179.22 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 568' ' ' GLN . . . . . 0.41 ' HA ' ' OE1' ' A' ' 568' ' ' GLN . 9.5 mm-40 60.07 -167.22 0.18 Allowed 'General case' 0 C--O 1.249 1.069 0 C-N-CA 124.617 1.167 . . . . 0.0 112.278 176.339 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.41 69.61 1.65 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 122.914 1.34 . . . . 0.0 112.862 -177.606 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 16.9 m -159.16 -62.69 0.08 Allowed 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 105.333 -2.099 . . . . 0.0 105.333 175.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.522 ' HB ' ' HA3' ' A' ' 567' ' ' GLY . 55.5 mt -77.27 -40.18 29.17 Favored 'Isoleucine or valine' 0 CA--C 1.474 -1.972 0 CA-C-N 114.51 -1.223 . . . . 0.0 109.374 178.684 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 572' ' ' GLU . . . . . 0.483 ' O ' ' HB3' ' A' ' 575' ' ' ASN . 18.4 tp10 -73.01 -24.62 60.77 Favored 'General case' 0 N--CA 1.392 -3.371 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.245 -176.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 573' ' ' SER . . . . . 0.523 ' O ' ' HG3' ' A' ' 602' ' ' LYS . 15.0 m -62.91 -44.96 94.68 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.511 175.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 67.5 mt -54.03 -43.68 70.35 Favored 'General case' 0 C--O 1.21 -1.014 0 C-N-CA 123.878 0.871 . . . . 0.0 108.878 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 575' ' ' ASN . . . . . 0.483 ' HB3' ' O ' ' A' ' 572' ' ' GLU . 65.0 t30 -59.07 -38.6 79.83 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 125.759 1.624 . . . . 0.0 112.646 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -59.93 -43.88 94.69 Favored 'General case' 0 C--O 1.255 1.392 0 CA-C-O 122.321 1.057 . . . . 0.0 108.342 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 577' ' ' LYS . . . . . 0.433 ' HB2' ' HE3' ' A' ' 602' ' ' LYS . 80.7 tttt -74.11 -35.09 64.14 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.909 176.346 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.434 ' HB3' ' O ' ' A' ' 575' ' ' ASN . 39.9 tp -52.04 -42.14 62.86 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 123.772 0.829 . . . . 0.0 110.234 171.789 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.51 ' HG3' ' OE1' ' A' ' 595' ' ' GLN . 16.9 tpp180 -59.85 -41.48 91.52 Favored 'General case' 0 C--O 1.263 1.787 0 CA-C-O 121.705 0.764 . . . . 0.0 109.251 175.62 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 580' ' ' GLU . . . . . 0.428 ' HA ' ' NE2' ' A' ' 595' ' ' GLN . 38.2 tt0 -60.81 -38.92 87.04 Favored 'General case' 0 C--O 1.198 -1.607 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.846 173.343 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -63.79 -29.3 70.51 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 121.323 0.583 . . . . 0.0 111.496 173.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.417 ' O ' ' N ' ' A' ' 584' ' ' ILE . 13.5 m -65.89 -24.3 66.82 Favored 'General case' 0 C--O 1.209 -1.044 0 C-N-CA 125.625 1.57 . . . . 0.0 111.787 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.725 ' HA ' ' CD ' ' A' ' 588' ' ' GLU . 30.9 ptt-85 -33.97 16.73 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.934 0 N-CA-C 118.994 2.961 . . . . 0.0 118.994 174.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.417 ' N ' ' O ' ' A' ' 582' ' ' THR . 34.4 pt -80.0 -11.49 12.85 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 O-C-N 120.767 -1.208 . . . . 0.0 110.092 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 126.71 37.9 0.46 Allowed Glycine 0 N--CA 1.479 1.558 0 C-N-CA 118.758 -1.687 . . . . 0.0 114.286 173.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 586' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 588' ' ' GLU . 27.2 t70 -99.58 169.35 9.35 Favored 'General case' 0 C--N 1.263 -3.164 0 C-N-CA 126.264 1.825 . . . . 0.0 108.268 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.583 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 35.6 m -50.44 -1.44 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 CA-C-N 119.924 1.238 . . . . 0.0 111.085 168.035 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.725 ' CD ' ' HA ' ' A' ' 583' ' ' ARG . 0.0 OUTLIER -55.56 -17.04 4.67 Favored 'General case' 0 C--O 1.155 -3.881 0 C-N-CA 125.955 1.702 . . . . 0.0 110.956 167.795 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 589' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 9.2 mp -66.76 -43.23 84.64 Favored 'General case' 0 C--O 1.286 2.992 0 CA-C-O 122.629 1.204 . . . . 0.0 109.373 170.357 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 590' ' ' GLN . . . . . 0.583 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 58.2 tp60 -56.28 -40.37 74.16 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 113.775 -1.557 . . . . 0.0 107.944 174.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.403 ' HB2' ' HA ' ' A' ' 588' ' ' GLU . 40.2 mmtm -84.29 -13.01 53.65 Favored 'General case' 0 C--O 1.189 -2.118 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.408 174.74 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 592' ' ' TYR . . . . . 0.534 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 43.0 t80 -60.15 -40.94 91.6 Favored 'General case' 0 CA--C 1.456 -2.653 0 C-N-CA 124.047 0.939 . . . . 0.0 109.682 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -54.8 -46.4 74.48 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.274 173.467 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.55 ' O ' HG22 ' A' ' 598' ' ' VAL . 1.5 tt -61.16 -55.1 36.26 Favored 'General case' 0 C--O 1.207 -1.139 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.195 176.418 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.531 ' HG2' ' HA ' ' A' ' 592' ' ' TYR . 6.2 pt20 -64.87 -30.11 71.09 Favored 'General case' 0 C--O 1.197 -1.704 0 C-N-CA 124.285 1.034 . . . . 0.0 111.639 -171.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 596' ' ' GLN . . . . . 0.474 ' O ' ' HG3' ' A' ' 600' ' ' LYS . 49.5 tt0 -63.06 -59.68 4.47 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 106.666 -1.605 . . . . 0.0 106.666 176.767 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 75.2 mt -56.94 -62.72 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 CA-C-N 113.868 -1.515 . . . . 0.0 111.51 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 598' ' ' VAL . . . . . 0.55 HG22 ' O ' ' A' ' 594' ' ' LEU . 18.6 m -70.21 -35.71 64.41 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.551 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -172.932 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -67.83 -31.85 71.98 Favored 'General case' 0 CA--C 1.488 -1.416 0 CA-C-N 120.018 1.281 . . . . 0.0 110.706 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 600' ' ' LYS . . . . . 0.576 ' O ' ' HG3' ' A' ' 604' ' ' ARG . 98.9 mttt -60.98 -49.38 77.68 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 119.435 -0.906 . . . . 0.0 108.687 173.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -64.96 -32.54 74.31 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.848 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 573' ' ' SER . 0.4 OUTLIER -71.93 -43.49 65.21 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 603' ' ' GLU . . . . . 0.428 ' C ' ' H ' ' A' ' 605' ' ' MET . 10.8 mm-40 -73.22 -15.49 61.43 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.669 179.293 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 604' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' A' ' 600' ' ' LYS . 95.9 mtt180 -73.18 36.91 0.08 Allowed 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.811 0.844 . . . . 0.0 111.673 175.598 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 605' ' ' MET . . . . . 0.428 ' H ' ' C ' ' A' ' 603' ' ' GLU . 23.4 ptt? . . . . . 0 C--N 1.306 -1.296 0 C-N-CA 124.092 0.957 . . . . 0.0 109.235 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 . . . . . 0 N--CA 1.441 -0.875 0 CA-C-O 121.639 0.733 . . . . 0.0 112.618 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -76.27 96.92 4.05 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 174.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 21.3 p-10 -135.11 46.87 2.38 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-O 122.78 1.276 . . . . 0.0 108.932 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -71.57 134.75 46.66 Favored 'General case' 0 N--CA 1.412 -2.327 0 CA-C-N 113.683 -1.599 . . . . 0.0 108.657 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.8 m -57.04 107.37 0.4 Allowed 'General case' 0 C--N 1.289 -2.036 0 O-C-N 124.278 0.986 . . . . 0.0 113.012 -174.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 4.9 ptm85 -65.2 -22.89 66.95 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 177.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.68 ' NE2' ' HB3' ' A' ' 566' ' ' LYS . 97.4 mt-30 -66.3 -32.15 73.38 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 174.247 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.645 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 3.2 tm-20 -71.24 -28.47 64.2 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.41 ' HA ' ' CD ' ' A' ' 474' ' ' ARG . 12.8 tmtt? -66.69 -35.42 80.1 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.513 176.286 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.47 99.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.157 0.504 . . . . 0.0 109.72 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -66.35 -35.6 80.75 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.92 177.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.645 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 90.8 mtt180 -57.24 -43.29 82.78 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 175.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 475' ' ' ALA . . . . . 0.467 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -66.19 -48.36 70.93 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.477 178.026 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.94 -8.31 6.91 Favored 'General case' 0 C--O 1.25 1.129 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 178.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.681 ' O ' ' HG ' ' A' ' 480' ' ' LEU . 1.0 OUTLIER -55.83 -27.87 53.52 Favored 'General case' 0 C--O 1.21 -1.025 0 O-C-N 122.053 -0.404 . . . . 0.0 111.314 174.824 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 47.8 pttt -56.83 -7.96 0.53 Allowed 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 124.486 1.114 . . . . 0.0 112.495 176.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.552 ' CD2' ' HA ' ' A' ' 487' ' ' PHE . 24.1 p-80 -52.95 -31.24 39.38 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.312 1.045 . . . . 0.0 110.335 177.319 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.681 ' HG ' ' O ' ' A' ' 477' ' ' LEU . 1.9 pp -71.99 5.75 2.5 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.524 1.129 . . . . 0.0 113.221 -173.134 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 92.8 mmm -94.38 -27.57 15.99 Favored 'General case' 0 N--CA 1.42 -1.954 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.014 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 482' ' ' ARG . . . . . 0.588 ' HB3' ' OG1' ' A' ' 486' ' ' THR . 40.0 ttt180 -78.18 -98.57 0.02 OUTLIER 'General case' 0 C--N 1.367 1.338 0 C-N-CA 117.79 -1.564 . . . . 0.0 109.71 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -145.35 -94.65 0.1 Allowed 'General case' 0 C--N 1.385 2.14 0 C-N-CA 113.462 -3.295 . . . . 0.0 117.752 161.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -101.2 -43.75 5.89 Favored 'General case' 0 CA--C 1.482 -1.664 0 CA-C-O 122.718 1.247 . . . . 0.0 112.183 174.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 485' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' A' ' 489' ' ' ASN . 5.8 p-10 -54.16 -43.19 70.41 Favored 'General case' 0 CA--C 1.483 -1.602 0 CA-C-N 112.507 -2.133 . . . . 0.0 109.911 -175.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.588 ' OG1' ' HB3' ' A' ' 482' ' ' ARG . 2.7 m -67.4 -35.34 79.1 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.336 -174.424 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 487' ' ' PHE . . . . . 0.552 ' HA ' ' CD2' ' A' ' 479' ' ' HIS . 49.1 t80 -62.59 -55.67 25.02 Favored 'General case' 0 CA--C 1.496 -1.113 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.897 178.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 2.0 tp -75.63 -22.98 56.34 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.809 -176.783 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 485' ' ' ASP . 13.6 t-20 -63.23 -47.01 84.27 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -176.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.33 -32.8 24.1 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.163 -1.015 . . . . 0.0 111.53 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -69.93 -38.02 76.09 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 123.408 0.683 . . . . 0.0 112.16 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -79.93 -30.16 39.88 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 120.906 0.384 . . . . 0.0 110.981 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 36.5 m -77.99 -40.41 39.23 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.577 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.8 t -99.72 100.02 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 CA-C-O 121.859 0.838 . . . . 0.0 109.436 -177.473 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -87.09 21.06 2.45 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.556 -176.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.453 ' NZ ' ' HB3' ' A' ' 496' ' ' LYS . 1.5 ttpm? -90.13 18.02 6.36 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -64.03 -20.44 65.92 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 124.79 1.236 . . . . 0.0 113.953 -171.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -82.33 -21.49 35.99 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.32 0.581 . . . . 0.0 110.492 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -79.79 -25.45 40.91 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.08 -179.134 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 3.3 m -67.3 140.03 57.29 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.91 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.03 175.75 2.99 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 124.841 1.256 . . . . 0.0 112.54 -176.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 502' ' ' GLN . . . . . 0.434 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -57.42 -19.69 25.22 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.626 1.17 . . . . 0.0 112.261 -178.211 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 503' ' ' HIS . . . . . 0.462 ' O ' HG23 ' A' ' 507' ' ' VAL . 17.1 t-160 -55.97 -40.01 72.64 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 125.146 1.378 . . . . 0.0 109.228 177.889 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 504' ' ' PHE . . . . . 0.541 ' O ' ' HD1' ' A' ' 508' ' ' PHE . 55.3 t80 -57.74 -53.16 61.31 Favored 'General case' 0 C--O 1.203 -1.365 0 C-N-CA 125.572 1.549 . . . . 0.0 108.619 177.247 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.434 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 72.5 tttt -57.93 -43.3 86.18 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 125.771 1.629 . . . . 0.0 111.923 -173.488 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -61.49 -56.11 23.72 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.49 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 507' ' ' VAL . . . . . 0.564 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 3.2 t -67.48 -46.99 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.705 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.808 -174.764 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 508' ' ' PHE . . . . . 0.541 ' HD1' ' O ' ' A' ' 504' ' ' PHE . 59.2 m-85 -55.3 -34.6 64.29 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 178.181 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -60.76 -52.43 65.14 Favored 'General case' 0 C--O 1.256 1.41 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 176.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 17.9 t -63.29 -46.26 96.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.898 177.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 93.5 mt -59.76 -49.28 78.34 Favored 'General case' 0 C--O 1.206 -1.198 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.545 -176.317 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -66.36 -28.7 68.85 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.737 0.303 . . . . 0.0 110.352 -177.394 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -70.44 -27.75 64.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.194 0.521 . . . . 0.0 110.249 177.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -83.07 -42.42 17.46 Favored 'General case' 0 CA--C 1.481 -1.677 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 175.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -50.24 -24.91 3.17 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.663 1.185 . . . . 0.0 111.349 176.779 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -52.71 -35.63 56.01 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 173.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -108.81 -61.32 1.63 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 119.62 -0.832 . . . . 0.0 109.482 173.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -159.14 135.71 9.3 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -75.84 97.01 3.8 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 120.47 1.486 . . . . 0.0 108.756 177.731 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -137.51 94.88 2.98 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.43 -176.424 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 521' ' ' TYR . . . . . 0.568 ' CE2' ' HB2' ' A' ' 526' ' ' ALA . 0.1 OUTLIER -58.45 143.63 44.82 Favored 'General case' 0 N--CA 1.401 -2.896 0 CA-C-O 121.604 0.716 . . . . 0.0 112.101 173.715 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -118.45 135.02 54.61 Favored 'General case' 0 C--N 1.285 -2.234 0 N-CA-C 105.14 -2.171 . . . . 0.0 105.14 173.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 523' ' ' ILE . . . . . 0.426 ' O ' HG12 ' A' ' 527' ' ' VAL . 3.9 tp -53.68 -34.47 24.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 O-C-N 123.659 0.599 . . . . 0.0 112.032 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 28.9 t -55.36 -48.86 73.61 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 122.977 0.511 . . . . 0.0 111.01 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.04 -42.85 99.61 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.89 0.852 . . . . 0.0 110.255 178.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.568 ' HB2' ' CE2' ' A' ' 521' ' ' TYR . . . -58.74 -52.99 63.33 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.788 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.426 HG12 ' O ' ' A' ' 523' ' ' ILE . 14.1 p -70.36 -36.23 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.924 0 C-N-CA 123.366 0.666 . . . . 0.0 111.998 -177.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -71.67 -12.95 61.59 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 121.074 -1.016 . . . . 0.0 110.651 177.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.63 ' HB3' ' HG3' ' A' ' 536' ' ' ARG . 0.0 OUTLIER -76.52 -3.91 39.89 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.991 173.229 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 530' ' ' VAL . . . . . . . . . . . . . 4.7 p -72.88 22.57 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.573 1.83 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -176.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -70.41 -34.96 73.12 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 121.186 -0.946 . . . . 0.0 108.635 174.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 23.1 t -91.42 111.04 22.37 Favored 'General case' 0 N--CA 1.42 -1.939 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 170.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -61.4 -60.98 2.88 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.098 -174.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -56.31 -46.58 79.78 Favored 'General case' 0 C--O 1.244 0.794 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.62 -174.811 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.59 -56.5 9.18 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.002 -173.069 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.63 ' HG3' ' HB3' ' A' ' 529' ' ' TYR . 2.3 mmt180 -72.4 -28.24 62.86 Favored 'General case' 0 N--CA 1.419 -2.018 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.45 -52.44 65.36 Favored 'General case' 0 C--O 1.251 1.174 0 CA-C-N 119.261 0.937 . . . . 0.0 110.002 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 541' ' ' SER . 1.9 p -63.93 -46.08 86.36 Favored 'General case' 0 N--CA 1.425 -1.689 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.284 177.55 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 19.0 tp -62.82 -32.89 74.18 Favored 'General case' 0 CA--C 1.56 1.341 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 540' ' ' ILE . . . . . 0.432 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 55.9 mt -66.94 -38.42 81.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 173.218 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 541' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 538' ' ' THR . 50.0 m -57.28 -38.54 74.08 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.047 172.658 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.615 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 3.9 mm? -71.78 -27.3 62.85 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 173.352 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -61.83 -56.09 23.11 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 174.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 544' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 540' ' ' ILE . 28.1 pt20 -80.21 13.25 2.42 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.665 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 545' ' ' TYR . . . . . 0.615 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 2.9 t80 -66.26 118.33 9.81 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.655 0.741 . . . . 0.0 110.93 177.524 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -94.03 120.62 34.54 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.714 -175.382 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.669 ' H ' HD13 ' A' ' 547' ' ' LEU . 0.0 OUTLIER -83.15 7.15 16.89 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -177.228 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -81.93 -21.13 37.46 Favored 'General case' 0 C--N 1.312 -1.049 0 O-C-N 121.304 -0.873 . . . . 0.0 109.799 175.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -69.31 -67.55 0.47 Allowed 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -86.5 111.65 40.9 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 167.485 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -50.1 146.61 17.13 Favored 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 123.464 2.776 . . . . 0.0 114.579 -170.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -73.97 -2.92 26.12 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 122.145 0.974 . . . . 0.0 111.043 -173.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -81.97 -41.59 20.56 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.518 170.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -73.07 -22.05 60.67 Favored 'General case' 0 C--O 1.185 -2.316 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -24.71 -70.3 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 126.629 1.972 . . . . 0.0 113.428 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 53.2 mt -68.46 -47.88 75.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.82 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -59.29 -48.89 79.92 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.097 -0.956 . . . . 0.0 113.026 -175.59 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -66.46 -51.39 57.31 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 124.084 0.953 . . . . 0.0 110.638 -177.549 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -51.58 -52.13 49.88 Favored 'General case' 0 C--O 1.246 0.872 0 C-N-CA 124.157 0.983 . . . . 0.0 110.474 176.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 95.0 t -66.91 -40.16 85.12 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.738 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -58.73 -39.4 80.77 Favored 'General case' 0 C--O 1.196 -1.757 0 C-N-CA 122.993 0.517 . . . . 0.0 110.637 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 562' ' ' VAL . . . . . 0.434 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 47.2 t -66.32 -36.59 77.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.418 0.628 . . . . 0.0 111.873 177.169 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.547 ' HA ' ' HG2' ' A' ' 469' ' ' GLN . 49.6 mt -78.67 -43.93 25.68 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 CA-C-O 121.738 0.78 . . . . 0.0 109.678 -177.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -77.94 -6.55 54.75 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.152 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.434 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 29.2 tt0 -61.74 -45.58 93.31 Favored 'General case' 0 CA--C 1.49 -1.346 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 175.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 566' ' ' LYS . . . . . 0.68 ' HB3' ' NE2' ' A' ' 469' ' ' GLN . 59.4 tttm -89.94 53.25 2.48 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 122.554 1.168 . . . . 0.0 108.129 178.207 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 567' ' ' GLY . . . . . 0.479 ' O ' HD12 ' A' ' 571' ' ' ILE . . . -102.7 -108.61 3.25 Favored Glycine 0 N--CA 1.419 -2.465 0 CA-C-N 113.941 -1.481 . . . . 0.0 110.619 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 568' ' ' GLN . . . . . 0.502 ' HA ' ' SD ' ' A' ' 605' ' ' MET . 51.8 tt0 78.29 170.42 0.2 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.459 1.103 . . . . 0.0 109.324 -174.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -42.43 129.72 3.92 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.921 1.289 . . . . 0.0 111.867 -174.261 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 38.1 m 87.76 -35.64 0.03 OUTLIER 'General case' 0 C--N 1.349 0.579 0 C-N-CA 126.766 2.026 . . . . 0.0 111.148 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.479 HD12 ' O ' ' A' ' 567' ' ' GLY . 4.5 mt -89.78 -22.93 6.29 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.302 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -176.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.4 -1.4 0.76 Allowed 'General case' 0 N--CA 1.418 -2.068 0 C-N-CA 125.826 1.65 . . . . 0.0 113.202 176.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 36.9 t -64.92 -20.82 66.65 Favored 'General case' 0 N--CA 1.418 -2.04 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 168.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 97.8 mt -61.21 -21.48 63.88 Favored 'General case' 0 C--O 1.199 -1.579 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.011 170.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 575' ' ' ASN . . . . . 0.495 ' O ' ' HB3' ' A' ' 578' ' ' LEU . 7.3 m-20 -59.09 -40.75 86.26 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 172.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 -62.78 -50.24 71.81 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -26.65 68.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.294 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.495 ' HB3' ' O ' ' A' ' 575' ' ' ASN . 0.8 OUTLIER -57.57 -44.22 85.14 Favored 'General case' 0 C--O 1.256 1.439 0 C-N-CA 123.903 0.881 . . . . 0.0 109.898 172.362 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.466 ' HA ' ' CD ' ' A' ' 591' ' ' LYS . 40.5 ttp180 -63.87 -43.01 97.35 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.014 174.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.91 -52.41 57.81 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 123.656 0.598 . . . . 0.0 111.579 175.15 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -57.47 -38.29 74.29 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.46 ' C ' ' H ' ' A' ' 584' ' ' ILE . 3.6 m -71.38 -23.63 61.92 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 177.067 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 583' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -51.44 -1.21 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 173.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.46 ' H ' ' C ' ' A' ' 582' ' ' THR . 13.9 tt -74.85 31.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.58 2.119 0 C-N-CA 125.667 1.587 . . . . 0.0 111.269 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 130.58 -25.86 4.17 Favored Glycine 0 C--N 1.296 -1.667 0 N-CA-C 117.538 1.775 . . . . 0.0 117.538 168.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 586' ' ' ASP . . . . . 0.545 ' O ' ' HB2' ' A' ' 590' ' ' GLN . 23.2 t70 -138.11 89.22 2.38 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-N 120.331 2.066 . . . . 0.0 111.808 176.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.488 ' O ' ' HB3' ' A' ' 591' ' ' LYS . 35.2 m -71.55 -41.84 72.15 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 CA-C-N 114.41 -1.268 . . . . 0.0 112.912 178.076 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -67.02 -70.88 0.22 Allowed 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -168.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 36.5 tp -76.03 -50.48 14.67 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.839 -172.474 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 590' ' ' GLN . . . . . 0.545 ' HB2' ' O ' ' A' ' 586' ' ' ASP . 32.3 mm-40 -55.47 -50.31 70.21 Favored 'General case' 0 CA--C 1.494 -1.178 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.475 178.585 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.667 ' HA ' ' HE3' ' A' ' 591' ' ' LYS 0.269 1.6 tpmt? -81.2 -32.89 33.29 Favored 'General case' 0 N--CA 1.4 -2.926 0 C-N-CA 117.572 -1.651 . . . . 0.0 113.449 -173.297 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -53.79 -52.03 61.56 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.103 0.865 . . . . 0.0 110.075 177.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 593' ' ' TYR . . . . . 0.45 ' O ' HG13 ' A' ' 597' ' ' ILE . 56.4 t80 -59.74 -59.13 5.92 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.359 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.4 HD13 ' O ' ' A' ' 590' ' ' GLN . 7.3 mp -59.65 -45.64 91.4 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -177.461 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.439 ' HA ' HG12 ' A' ' 598' ' ' VAL . 4.9 pp0? -69.69 -34.75 74.38 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 122.193 -0.317 . . . . 0.0 111.547 -175.18 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -63.53 -44.39 94.35 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 593' ' ' TYR . 77.3 mt -55.03 -56.78 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.114 177.374 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 598' ' ' VAL . . . . . 0.439 HG12 ' HA ' ' A' ' 595' ' ' GLN . 7.3 p -67.06 -36.09 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -62.69 -44.51 96.06 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-O 121.928 0.871 . . . . 0.0 110.15 178.553 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -69.59 -33.76 73.16 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.608 177.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -66.49 -38.41 87.21 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.263 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 602' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -69.75 -39.39 76.76 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.911 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.86 -25.33 62.77 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 119.514 -0.874 . . . . 0.0 110.323 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -68.56 -26.19 65.28 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.681 175.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 605' ' ' MET . . . . . 0.502 ' SD ' ' HA ' ' A' ' 568' ' ' GLN . 43.9 ttm . . . . . 0 C--O 1.245 0.855 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 -178.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 37.8 p90 . . . . . 0 N--CA 1.434 -1.229 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -91.0 107.15 19.01 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.567 174.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -124.02 46.54 2.24 Favored 'General case' 0 C--N 1.288 -2.072 0 C-N-CA 119.246 -0.982 . . . . 0.0 109.057 178.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 98.9 mt -75.97 89.01 2.95 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 168.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 17.0 m -58.9 136.72 57.95 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 114.021 -1.445 . . . . 0.0 114.298 -171.113 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -65.83 -32.78 74.5 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.911 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.487 ' HG2' ' HA ' ' A' ' 563' ' ' ILE . 97.3 mt-30 -64.28 -41.85 96.69 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 175.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 5.8 tm-20 -63.34 -29.05 70.42 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.287 178.335 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.414 ' HD3' ' HA ' ' A' ' 471' ' ' LYS . 25.9 mmtm -66.34 -37.86 86.32 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.555 171.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.44 -36.96 71.44 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.118 -177.998 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 473' ' ' GLU . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 504' ' ' PHE . 0.9 OUTLIER -57.94 -40.81 81.4 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 123.327 0.392 . . . . 0.0 110.777 171.863 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 93.4 mtt180 -62.37 -42.81 99.7 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 177.285 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -67.44 -29.88 69.47 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.058 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -66.03 -33.58 76.12 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.68 0.752 . . . . 0.0 109.875 177.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 87.3 mt -76.52 10.57 2.03 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.446 177.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.437 ' HE3' ' CD2' ' A' ' 545' ' ' TYR . 18.9 tptm -59.88 -10.62 4.18 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.433 1.093 . . . . 0.0 112.989 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -74.76 142.03 44.35 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.908 -0.495 . . . . 0.0 111.424 -176.144 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.733 ' H ' HD13 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -75.66 -150.77 0.03 OUTLIER 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.792 175.252 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 481' ' ' MET . . . . . 0.465 ' C ' ' H ' ' A' ' 483' ' ' ASP . 66.8 mtt -50.4 -9.88 0.05 Allowed 'General case' 0 N--CA 1.516 2.851 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 -177.411 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -72.92 7.12 2.18 Favored 'General case' 0 CA--C 1.561 1.386 0 C-N-CA 125.185 1.394 . . . . 0.0 109.518 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 483' ' ' ASP . . . . . 0.465 ' H ' ' C ' ' A' ' 481' ' ' MET . 5.5 p-10 -70.41 -10.96 60.52 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 125.701 1.6 . . . . 0.0 113.65 -170.178 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -63.02 -44.63 95.44 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.738 0.78 . . . . 0.0 109.649 176.086 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.61 -51.67 66.38 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 114.726 -1.124 . . . . 0.0 109.649 178.428 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 59.0 m -61.81 -40.64 95.95 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 114.561 -1.199 . . . . 0.0 111.995 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 487' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 23.1 t80 -56.57 -53.28 59.4 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 122.394 0.278 . . . . 0.0 110.734 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.437 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 65.8 mt -72.73 -25.46 61.22 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.588 -178.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -69.23 -39.85 78.28 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.636 0.731 . . . . 0.0 110.085 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.79 -21.48 26.47 Favored 'General case' 0 N--CA 1.424 -1.737 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.326 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 491' ' ' TYR . . . . . 0.549 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.3 OUTLIER -67.03 -41.24 86.94 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 123.801 0.84 . . . . 0.0 109.332 178.878 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 492' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 8.9 pt-20 -77.92 -46.32 21.6 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -176.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 27.5 p -89.98 -28.65 18.98 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -170.435 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 47.0 t -91.2 162.7 2.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 O-C-N 122.012 -0.43 . . . . 0.0 111.187 -170.297 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -75.09 109.82 8.88 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 121.896 0.855 . . . . 0.0 111.05 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -88.9 -25.02 22.34 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.143 -1.389 . . . . 0.0 108.715 176.752 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -86.75 -66.57 0.89 Allowed 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 118.845 2.906 . . . . 0.0 118.845 -166.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -107.27 -34.15 7.19 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 118.723 2.86 . . . . 0.0 118.723 -160.223 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -76.77 -94.97 0.02 OUTLIER 'General case' 0 CA--C 1.566 1.574 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -163.725 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 19.6 m -129.84 76.08 1.7 Allowed 'General case' 0 C--N 1.314 -0.977 0 O-C-N 120.794 -1.191 . . . . 0.0 109.303 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -130.79 45.87 2.75 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 117.397 2.369 . . . . 0.0 117.397 -170.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -84.85 -33.65 22.8 Favored 'General case' 0 CA--C 1.492 -1.278 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 170.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 503' ' ' HIS . . . . . 0.561 ' CD2' HD11 ' A' ' 535' ' ' LEU . 45.4 m170 -59.25 -51.68 68.94 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 504' ' ' PHE . . . . . 0.444 ' CZ ' ' HB3' ' A' ' 473' ' ' GLU . 97.0 m-85 -68.01 -25.76 65.55 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 113.973 -1.467 . . . . 0.0 114.308 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -63.83 -46.83 83.32 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 175.522 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.583 ' O ' HG23 ' A' ' 510' ' ' VAL . 2.6 t80 -64.37 -32.56 74.23 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.893 -1.049 . . . . 0.0 112.379 174.892 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.53 -50.4 72.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 173.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -51.98 -43.01 63.38 Favored 'General case' 0 C--N 1.355 0.845 0 CA-C-O 120.899 0.38 . . . . 0.0 110.126 173.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -55.98 -60.11 3.95 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.341 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 506' ' ' TYR . 21.5 t -58.07 -53.58 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 O-C-N 123.57 0.544 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.58 -36.94 85.25 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -174.007 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -70.06 -32.2 70.18 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.485 -0.486 . . . . 0.0 109.808 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -72.43 -27.69 62.49 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 178.22 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -67.04 -54.24 23.49 Favored 'General case' 0 CA--C 1.49 -1.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.907 171.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 515' ' ' TYR . . . . . 0.436 ' HA ' ' HB3' ' A' ' 519' ' ' ASP . 0.4 OUTLIER -49.96 -29.68 8.95 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.801 0.84 . . . . 0.0 112.552 178.333 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -63.77 -36.23 83.21 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.572 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -111.89 -59.41 1.99 Allowed 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.4 -176.116 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -157.31 118.81 3.69 Favored 'General case' 0 CA--C 1.493 -1.224 0 C-N-CA 125.148 1.379 . . . . 0.0 107.659 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 519' ' ' ASP . . . . . 0.436 ' HB3' ' HA ' ' A' ' 515' ' ' TYR . 2.2 p-10 -90.95 92.51 8.79 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -175.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -144.4 128.93 18.05 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 126.49 1.916 . . . . 0.0 107.055 162.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -70.32 132.42 45.65 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 119.546 1.066 . . . . 0.0 110.453 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 -118.73 135.0 54.73 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 34.5 pt -79.47 -16.21 13.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 122.152 0.977 . . . . 0.0 110.216 -175.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.402 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 5.6 p -60.05 -30.9 69.5 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.258 172.318 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.73 -39.64 91.34 Favored 'General case' 0 CA--C 1.481 -1.675 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.771 178.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.3 99.59 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.325 -0.95 . . . . 0.0 109.34 175.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.432 ' O ' HG12 ' A' ' 530' ' ' VAL . 61.5 t -61.8 -35.92 70.65 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.375 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.966 175.416 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 528' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.5 mm100 -72.24 -24.24 61.34 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 121.498 -0.751 . . . . 0.0 111.332 176.517 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.409 ' CE2' HG22 ' A' ' 510' ' ' VAL . 9.2 m-85 -79.64 -23.08 42.82 Favored 'General case' 0 N--CA 1.44 -0.97 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 175.788 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.432 HG12 ' O ' ' A' ' 527' ' ' VAL 0.369 12.2 p -75.93 55.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.241 0.606 0 CA-C-O 123.062 1.41 . . . . 0.0 114.034 -177.99 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -105.0 -29.95 10.1 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 104.209 -2.515 . . . . 0.0 104.209 172.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 46.5 m -92.92 161.9 14.29 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 164.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -86.29 -58.43 2.63 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 -176.143 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.17 -79.64 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 -161.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.561 HD11 ' CD2' ' A' ' 503' ' ' HIS . 2.6 mm? -75.44 -17.27 60.2 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 122.109 0.956 . . . . 0.0 112.132 -172.252 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -77.84 -46.0 22.72 Favored 'General case' 0 C--N 1.272 -2.799 0 CA-C-N 113.775 -1.557 . . . . 0.0 107.523 -173.604 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -66.5 -38.32 86.98 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.086 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 32.1 m -57.07 -51.61 68.6 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.709 178.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 27.9 tp -57.7 -45.55 85.52 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 111.323 0.12 . . . . 0.0 111.323 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 78.9 mt -60.18 -37.79 74.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-O 121.424 0.631 . . . . 0.0 110.289 176.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.7 m -57.27 -35.41 69.73 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.474 176.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.31 -43.89 69.41 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.903 0.382 . . . . 0.0 110.218 174.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -60.9 -36.43 79.23 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.09 0.956 . . . . 0.0 113.084 -177.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -72.48 23.81 0.06 Allowed 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 545' ' ' TYR . . . . . 0.437 ' CD2' ' HE3' ' A' ' 478' ' ' LYS . 50.7 t80 -65.92 147.16 53.8 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.137 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -87.59 173.67 8.91 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -173.199 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.412 ' C ' ' H ' ' A' ' 549' ' ' ASP . 7.7 mp -80.53 21.42 0.64 Allowed 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -174.234 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 23.2 p-10 -77.02 22.78 0.19 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.197 0.599 . . . . 0.0 111.98 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 549' ' ' ASP . . . . . 0.412 ' H ' ' C ' ' A' ' 547' ' ' LEU . 23.0 m-20 -63.67 3.84 0.32 Allowed 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 127.148 2.179 . . . . 0.0 115.181 -175.365 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.475 ' HB3' ' HD2' ' A' ' 551' ' ' PRO . 47.0 mt-10 -60.26 151.57 67.19 Favored Pre-proline 0 C--N 1.308 -1.199 0 CA-C-O 118.789 -0.624 . . . . 0.0 109.74 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 551' ' ' PRO . . . . . 0.475 ' HD2' ' HB3' ' A' ' 550' ' ' GLU . 1.9 Cg_exo 8.99 74.71 0.0 OUTLIER 'Trans proline' 0 C--N 1.379 2.179 1 C-N-CA 126.534 4.823 . . . . 0.0 117.032 -164.339 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 56.0 p90 -84.56 5.0 29.46 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.574 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -73.5 10.4 1.06 Allowed 'General case' 0 C--N 1.288 -2.102 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -176.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 554' ' ' ASN . . . . . 0.497 ' HA ' ' HG3' ' A' ' 583' ' ' ARG . 24.1 p-10 -76.04 -21.66 56.56 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 168.458 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -25.41 -75.38 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 127.322 2.249 . . . . 0.0 113.348 178.643 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 22.4 pt -61.99 -35.73 70.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 C-N-CA 123.85 0.86 . . . . 0.0 112.432 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.34 -54.11 47.96 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 558' ' ' ASP . . . . . 0.714 ' HA ' ' CE1' ' A' ' 576' ' ' HIS . 28.7 t70 -63.43 -46.34 86.76 Favored 'General case' 0 C--O 1.201 -1.496 0 CA-C-N 113.897 -1.501 . . . . 0.0 110.909 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 559' ' ' TYR . . . . . 0.597 ' O ' HG12 ' A' ' 563' ' ' ILE . 75.5 t80 -57.77 -53.3 59.72 Favored 'General case' 0 C--N 1.291 -1.94 0 C-N-CA 123.798 0.839 . . . . 0.0 112.009 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 71.6 t -63.55 -46.63 94.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.445 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 64.4 m-20 -60.32 -47.7 84.9 Favored 'General case' 0 C--O 1.175 -2.842 0 CA-C-O 118.151 -0.928 . . . . 0.0 112.149 177.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 562' ' ' VAL . . . . . 0.49 ' HA ' ' HG2' ' A' ' 565' ' ' GLU . 55.6 t -60.38 -47.87 90.66 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.991 0 CA-C-N 119.271 0.941 . . . . 0.0 111.289 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.597 HG12 ' O ' ' A' ' 559' ' ' TYR . 38.5 mm -66.03 -32.41 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-O 121.543 0.687 . . . . 0.0 110.321 -176.334 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -92.29 -22.76 19.56 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -175.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.49 ' HG2' ' HA ' ' A' ' 562' ' ' VAL . 6.9 pt-20 -85.24 -28.69 25.2 Favored 'General case' 0 CA--C 1.505 -0.76 0 C-N-CA 119.473 -0.891 . . . . 0.0 109.039 -175.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 566' ' ' LYS . . . . . 0.474 ' HA ' ' HE3' ' A' ' 566' ' ' LYS . 0.0 OUTLIER -80.32 14.67 1.87 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.942 -175.78 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -71.92 -45.26 43.31 Favored Glycine 0 N--CA 1.441 -1.025 0 N-CA-C 109.686 -1.366 . . . . 0.0 109.686 174.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 6.5 pm0 -136.98 -2.17 2.11 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 122.782 0.433 . . . . 0.0 110.724 176.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 66.6 101.92 0.04 OUTLIER 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.507 1.523 . . . . 0.0 109.384 -176.414 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 570' ' ' THR . . . . . 0.536 ' HB ' ' OE1' ' A' ' 572' ' ' GLU . 19.6 p -93.4 -173.88 3.34 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 116.11 1.893 . . . . 0.0 116.11 -167.108 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.0 mt -89.64 -31.62 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.065 0 N-CA-C 104.114 -2.55 . . . . 0.0 104.114 173.91 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 572' ' ' GLU . . . . . 0.536 ' OE1' ' HB ' ' A' ' 570' ' ' THR . 3.2 mp0 -59.23 -19.1 42.83 Favored 'General case' 0 C--O 1.197 -1.709 0 CA-C-N 112.868 -1.969 . . . . 0.0 110.715 177.025 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 50.3 m -59.56 -41.53 90.34 Favored 'General case' 0 N--CA 1.427 -1.606 0 C-N-CA 123.483 0.713 . . . . 0.0 109.414 174.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 6.4 mp -70.25 -45.55 66.23 Favored 'General case' 0 C--O 1.256 1.444 0 CA-C-O 121.828 0.823 . . . . 0.0 110.182 177.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -59.9 -35.25 74.45 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.052 176.465 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 576' ' ' HIS . . . . . 0.714 ' CE1' ' HA ' ' A' ' 558' ' ' ASP . 15.0 t60 -59.61 -41.29 90.03 Favored 'General case' 0 C--O 1.202 -1.435 0 C-N-CA 123.015 0.526 . . . . 0.0 111.184 175.177 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -53.28 -54.85 30.24 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.447 HD12 ' HG2' ' A' ' 595' ' ' GLN . 69.3 mt -64.35 -39.53 94.07 Favored 'General case' 0 CA--C 1.57 1.741 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.818 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.777 ' O ' ' HB ' ' A' ' 582' ' ' THR . 36.1 ttt180 -64.3 -32.03 73.47 Favored 'General case' 0 C--O 1.264 1.84 0 C-N-CA 124.383 1.073 . . . . 0.0 113.433 176.61 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -67.63 -41.69 83.52 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.106 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 581' ' ' ALA . . . . . 0.496 ' O ' HD13 ' A' ' 589' ' ' LEU . . . -62.75 -30.55 71.52 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.445 172.609 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.777 ' HB ' ' O ' ' A' ' 579' ' ' ARG . 23.2 m -60.46 -42.83 96.99 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.892 0.877 . . . . 0.0 112.822 -178.498 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.497 ' HG3' ' HA ' ' A' ' 554' ' ' ASN 0.34 20.8 mmm180 -39.75 -31.61 0.11 Allowed 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 120.789 3.625 . . . . 0.0 120.789 -171.868 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 7.2 tp -80.32 -30.1 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 CA-C-N 120.659 1.572 . . . . 0.0 111.573 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 90.03 49.47 3.31 Favored Glycine 0 C--N 1.309 -0.94 0 N-CA-C 116.142 1.217 . . . . 0.0 116.142 174.372 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -85.15 162.41 19.25 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 172.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 34.4 m -59.18 -39.3 78.31 Favored 'Isoleucine or valine' 0 C--O 1.264 1.833 0 CA-C-N 118.691 0.678 . . . . 0.0 112.239 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.503 ' O ' ' HD1' ' A' ' 592' ' ' TYR . 41.1 mm-40 -67.11 -34.89 78.59 Favored 'General case' 0 CA--C 1.476 -1.89 0 O-C-N 121.312 -0.868 . . . . 0.0 109.235 176.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 589' ' ' LEU . . . . . 0.496 HD13 ' O ' ' A' ' 581' ' ' ALA . 79.8 mt -73.73 -17.32 61.13 Favored 'General case' 0 N--CA 1.416 -2.164 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.691 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 590' ' ' GLN . . . . . 0.419 ' O ' ' HB3' ' A' ' 593' ' ' TYR . 51.5 tt0 -64.95 -38.59 91.48 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 167.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.763 ' O ' ' HB3' ' A' ' 594' ' ' LEU . 89.8 mttt -63.13 -34.14 76.96 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-O 123.066 1.413 . . . . 0.0 109.237 172.014 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 592' ' ' TYR . . . . . 0.544 ' O ' ' HB2' ' A' ' 595' ' ' GLN . 10.9 m-85 -64.26 -39.78 94.63 Favored 'General case' 0 CA--C 1.589 2.467 0 CA-C-O 122.493 1.14 . . . . 0.0 109.612 171.35 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 593' ' ' TYR . . . . . 0.575 ' HA ' ' OE1' ' A' ' 596' ' ' GLN . 71.5 t80 -58.55 -29.32 66.27 Favored 'General case' 0 CA--C 1.559 1.3 0 O-C-N 121.602 -0.686 . . . . 0.0 110.666 171.038 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.763 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 11.6 tp -58.77 -39.09 79.98 Favored 'General case' 0 C--O 1.211 -0.954 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 170.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.544 ' HB2' ' O ' ' A' ' 592' ' ' TYR . 5.5 mp0 -55.04 -36.54 65.64 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.182 173.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 596' ' ' GLN . . . . . 0.583 ' NE2' ' HB2' ' A' ' 579' ' ' ARG . 0.9 OUTLIER -60.96 -47.72 85.12 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.69 172.56 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.28 -39.24 66.46 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.84 174.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 598' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 594' ' ' LEU . 87.9 t -65.3 -40.64 89.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 123.304 0.642 . . . . 0.0 111.059 177.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.516 ' O ' ' HG3' ' A' ' 602' ' ' LYS . . . -61.98 -43.88 97.92 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.076 -0.712 . . . . 0.0 109.076 177.349 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 49.1 tttm -63.89 -39.82 95.06 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 114.834 -1.075 . . . . 0.0 110.049 175.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 601' ' ' ASN . . . . . 0.592 ' O ' ' HB3' ' A' ' 604' ' ' ARG . 9.0 t30 -64.74 -36.39 84.13 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 123.403 0.681 . . . . 0.0 111.341 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 599' ' ' ALA . 0.0 OUTLIER -73.64 -30.97 63.26 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.235 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -73.64 -19.4 60.86 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.926 0.87 . . . . 0.0 110.439 176.156 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 604' ' ' ARG . . . . . 0.592 ' HB3' ' O ' ' A' ' 601' ' ' ASN . 65.5 ttt180 -70.88 -13.17 61.93 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 124.614 1.166 . . . . 0.0 109.687 174.537 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 80.4 mmm . . . . . 0 C--O 1.251 1.147 0 C-N-CA 125.798 1.639 . . . . 0.0 110.527 -179.625 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.412 -2.335 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -85.18 -173.27 4.61 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.0 0.428 . . . . 0.0 111.088 -175.119 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -96.7 74.29 2.72 Favored 'General case' 0 N--CA 1.423 -1.808 0 CA-C-O 122.356 1.074 . . . . 0.0 110.248 -176.741 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 73.9 mt -58.07 119.82 7.48 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 113.486 -1.688 . . . . 0.0 107.802 174.54 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 49.6 m -98.67 105.63 17.8 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -167.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -68.09 -40.13 82.72 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 114.504 -1.225 . . . . 0.0 107.95 171.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -59.0 -32.14 69.42 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 113.517 -1.674 . . . . 0.0 110.856 -178.677 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.607 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 38.0 tt0 -67.16 -34.97 78.69 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.211 178.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.494 ' O ' ' HD3' ' A' ' 471' ' ' LYS . 2.2 tmtp? -66.66 -41.6 87.95 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -178.012 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 472' ' ' ALA . . . . . 0.437 ' HB3' HD11 ' A' ' 563' ' ' ILE . . . -60.06 -41.29 92.05 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.987 177.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 473' ' ' GLU . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 504' ' ' PHE . 0.3 OUTLIER -66.21 -39.41 89.61 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.386 179.629 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.607 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 98.2 mtt180 -55.08 -45.08 75.37 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.152 0.501 . . . . 0.0 109.83 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -68.14 -42.55 79.94 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.03 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -63.02 -52.81 61.45 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.799 -177.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.79 -40.42 92.53 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 124.007 0.817 . . . . 0.0 109.865 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 19.5 tttp -49.17 -70.69 0.08 Allowed 'General case' 0 C--O 1.221 -0.425 0 O-C-N 123.888 0.742 . . . . 0.0 111.994 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . 0.26 16.6 m170 27.97 -100.92 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 115.324 1.602 . . . . 0.0 115.324 -174.268 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 78.9 mt -166.46 179.95 5.27 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 126.084 1.754 . . . . 0.0 106.762 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 1.4 pmm? -75.93 -8.41 56.85 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.783 0.802 . . . . 0.0 110.293 178.091 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -63.08 -47.24 83.73 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 124.76 1.224 . . . . 0.0 110.392 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 483' ' ' ASP . . . . . 0.523 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 3.3 m-20 -71.34 43.71 0.08 Allowed 'General case' 0 C--N 1.285 -2.203 0 C-N-CA 126.647 1.979 . . . . 0.0 115.78 -172.567 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -67.57 -39.77 84.91 Favored 'General case' 0 C--O 1.247 0.929 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.21 -52.53 65.17 Favored 'General case' 0 C--O 1.205 -1.282 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.242 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.523 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 3.4 m -56.92 -42.73 80.51 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 124.661 1.184 . . . . 0.0 111.22 -177.38 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 487' ' ' PHE . . . . . 0.463 ' CE1' ' HE2' ' A' ' 491' ' ' TYR . 84.0 t80 -51.3 -56.61 12.11 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.637 0.775 . . . . 0.0 109.719 175.483 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 63.7 mt -74.81 -28.3 60.66 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 122.085 -0.384 . . . . 0.0 111.341 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -69.81 -27.12 64.62 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.288 0.566 . . . . 0.0 110.859 -177.839 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.22 -40.31 19.79 Favored 'General case' 0 N--CA 1.414 -2.233 0 C-N-CA 120.084 -0.646 . . . . 0.0 109.318 177.28 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 491' ' ' TYR . . . . . 0.463 ' HE2' ' CE1' ' A' ' 487' ' ' PHE . 42.1 m-85 -58.01 -32.64 68.13 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.577 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -77.71 -38.85 46.41 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.607 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 17.8 t -87.23 -39.28 15.58 Favored 'General case' 0 C--O 1.249 1.074 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -173.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 41.9 t -92.97 166.66 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 -175.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -80.27 117.39 21.0 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -67.96 -44.37 76.87 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.078 -176.399 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.07 -53.86 47.03 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 -169.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -76.69 -35.0 58.17 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.176 -174.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 499' ' ' PHE . . . . . 0.442 ' CZ ' HG23 ' A' ' 563' ' ' ILE 0.262 37.2 m-85 -78.6 -15.25 58.75 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -178.357 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 57.4 m -77.04 86.91 3.54 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 118.737 -1.185 . . . . 0.0 108.379 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -84.45 -178.2 6.84 Favored 'General case' 0 C--O 1.208 -1.112 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -63.15 -35.38 80.1 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.309 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -59.31 -56.92 15.9 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.565 -1.652 . . . . 0.0 108.422 177.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 504' ' ' PHE . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 473' ' ' GLU 0.309 57.6 m-85 -66.73 -26.83 67.19 Favored 'General case' 0 N--CA 1.421 -1.88 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 178.865 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 36.1 tttm -63.0 -47.6 82.41 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 175.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.567 ' O ' HG23 ' A' ' 510' ' ' VAL . 9.2 m-85 -52.51 -60.7 2.92 Favored 'General case' 0 N--CA 1.439 -1.022 0 O-C-N 124.506 1.129 . . . . 0.0 110.937 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 507' ' ' VAL . . . . . 0.47 HG22 ' HA ' ' A' ' 504' ' ' PHE . 22.7 m -65.45 -44.81 94.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -50.49 -51.83 43.7 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.094 0.557 . . . . 0.0 110.604 176.164 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -57.74 -51.93 67.52 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.541 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 506' ' ' TYR . 21.8 t -62.42 -47.6 92.26 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 O-C-N 123.475 0.484 . . . . 0.0 111.764 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 3.8 tt -68.2 -41.33 81.53 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.859 -174.468 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -66.53 -41.98 87.94 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.376 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -64.23 -49.33 72.36 Favored 'General case' 0 CA--C 1.501 -0.907 0 C-N-CA 123.272 0.629 . . . . 0.0 110.763 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -61.63 -46.96 87.54 Favored 'General case' 0 C--O 1.177 -2.738 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.946 177.073 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 515' ' ' TYR . . . . . 0.468 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 0.5 OUTLIER -48.29 -39.94 23.32 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.761 0.824 . . . . 0.0 110.0 -179.323 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.15 -56.52 5.92 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.467 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -95.48 -11.06 28.14 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -169.046 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -150.96 -151.29 0.38 Allowed 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 106.449 -1.686 . . . . 0.0 106.449 -175.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -97.38 -162.95 1.0 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 176.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -83.77 -170.69 3.2 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 118.431 0.56 . . . . 0.0 112.299 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -41.69 118.78 1.15 Allowed 'General case' 0 N--CA 1.418 -2.069 0 N-CA-C 115.559 1.689 . . . . 0.0 115.559 -178.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -107.27 111.55 23.98 Favored 'General case' 0 N--CA 1.415 -2.194 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 172.704 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 30.7 pt -54.78 -28.04 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.098 1.359 . . . . 0.0 112.901 -174.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 10.2 m -58.51 -31.52 67.96 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.563 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -36.65 77.91 Favored 'General case' 0 C--O 1.245 0.852 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.634 ' HA ' ' CD2' ' A' ' 529' ' ' TYR . . . -61.52 -35.6 78.18 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.04 178.336 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 52.3 t -67.91 -34.86 69.71 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.496 0 C-N-CA 124.381 1.072 . . . . 0.0 108.996 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 91.7 mt-30 -66.44 -20.74 66.13 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.051 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.634 ' CD2' ' HA ' ' A' ' 526' ' ' ALA . 18.9 m-85 -74.65 7.14 3.22 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.172 173.33 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.467 ' HA ' ' CB ' ' A' ' 536' ' ' ARG . 8.1 p -72.9 14.25 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.625 0 CA-C-O 122.334 1.064 . . . . 0.0 110.411 173.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 531' ' ' ASN . . . . . 0.437 ' H ' ' C ' ' A' ' 529' ' ' TYR . 46.3 m-80 -101.35 -21.18 14.91 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.584 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 532' ' ' SER . . . . . 0.549 ' OG ' ' HB2' ' A' ' 535' ' ' LEU . 80.9 p -83.91 157.89 21.79 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -63.5 -61.92 2.01 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -94.23 -40.5 9.97 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -173.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.549 ' HB2' ' OG ' ' A' ' 532' ' ' SER . 99.5 mt -62.99 -22.66 67.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -174.79 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.467 ' CB ' ' HA ' ' A' ' 530' ' ' VAL . 18.0 ptp180 -59.61 -42.84 93.54 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.428 0.632 . . . . 0.0 109.567 177.179 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -70.53 -56.53 6.33 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.274 -177.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.442 ' O ' HD13 ' A' ' 542' ' ' LEU . 12.9 m -59.12 -53.65 55.92 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.375 -176.486 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 539' ' ' LEU . . . . . 0.511 ' HB3' ' HB1' ' A' ' 526' ' ' ALA 0.262 4.4 mm? -61.72 -38.91 89.63 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.232 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 540' ' ' ILE . . . . . 0.578 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 69.4 mt -69.04 -36.77 75.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.052 176.665 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 57.5 m -56.17 -43.52 78.46 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.524 0.678 . . . . 0.0 109.617 173.149 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.442 HD13 ' O ' ' A' ' 538' ' ' THR . 8.8 mp -65.63 -31.23 72.15 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.114 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -70.9 -41.42 71.3 Favored 'General case' 0 C--N 1.317 -0.844 0 O-C-N 122.086 -0.384 . . . . 0.0 110.772 177.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 544' ' ' GLN . . . . . 0.578 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 76.5 mt-30 -69.9 -27.87 65.15 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.195 -177.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -67.48 118.59 11.02 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 174.351 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -124.7 130.67 52.85 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -168.165 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 61.9 tp -75.24 -27.89 59.66 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.956 -178.15 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -73.17 -36.81 66.67 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.806 -0.357 . . . . 0.0 111.058 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -68.73 -55.25 11.96 Favored 'General case' 0 CA--C 1.508 -0.673 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.382 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.53 114.5 25.26 Favored Pre-proline 0 C--N 1.298 -1.654 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.74 151.74 74.49 Favored 'Trans proline' 0 C--O 1.249 1.041 0 C-N-CA 122.585 2.19 . . . . 0.0 111.333 175.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -126.89 49.86 2.02 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.824 0.821 . . . . 0.0 111.307 -174.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.96 -12.63 60.0 Favored 'General case' 0 C--N 1.285 -2.23 0 CA-C-O 121.667 0.746 . . . . 0.0 112.314 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -79.29 -22.29 44.84 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 124.489 1.116 . . . . 0.0 108.789 173.477 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -39.07 -69.36 0.13 Allowed 'General case' 0 C--O 1.199 -1.56 0 C-N-CA 125.331 1.453 . . . . 0.0 111.585 -175.655 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 38.8 pt -54.1 -39.68 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 123.724 0.64 . . . . 0.0 112.193 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.35 -55.01 36.47 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.951 0.9 . . . . 0.0 110.995 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -73.96 -35.89 64.56 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.326 -175.58 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 559' ' ' TYR . . . . . 0.647 ' CE1' HD12 ' A' ' 563' ' ' ILE . 93.4 t80 -57.25 -52.74 64.11 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 125.164 1.386 . . . . 0.0 111.648 177.977 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 14.4 p -64.21 -38.37 82.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 109.811 -0.441 . . . . 0.0 109.811 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.483 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 27.1 t-20 -61.76 -45.41 94.02 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.476 178.422 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.54 -50.47 34.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -178.27 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.647 HD12 ' CE1' ' A' ' 559' ' ' TYR . 30.5 mt -95.85 -45.74 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.118 0 CA-C-O 121.793 0.806 . . . . 0.0 111.638 -167.897 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -81.24 6.75 13.11 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 122.485 1.136 . . . . 0.0 108.076 -175.11 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 4.2 tm-20 -57.91 -39.12 77.16 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 169.309 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -81.04 54.97 2.35 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.955 -1.475 . . . . 0.0 113.145 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . 173.91 66.63 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 118.79 -1.671 . . . . 0.0 115.215 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -118.78 142.9 47.27 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 117.832 0.816 . . . . 0.0 109.126 173.249 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -116.64 -38.91 3.39 Favored 'General case' 0 C--N 1.301 -1.541 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.935 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 570' ' ' THR . . . . . 0.445 HG22 ' H ' ' A' ' 572' ' ' GLU . 94.5 m -129.07 161.67 29.46 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 123.163 0.585 . . . . 0.0 109.579 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 11.8 tt -54.89 -44.96 75.03 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 C-N-CA 123.987 0.915 . . . . 0.0 111.253 175.293 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 572' ' ' GLU . . . . . 0.445 ' H ' HG22 ' A' ' 570' ' ' THR . 30.9 mt-10 -67.52 -23.73 65.48 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-O 119.042 -0.504 . . . . 0.0 112.099 177.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 8.4 m -62.28 -34.28 76.25 Favored 'General case' 0 C--O 1.206 -1.218 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 72.0 mt -60.95 -56.85 16.22 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 175.089 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 575' ' ' ASN . . . . . 0.462 ' O ' ' HG3' ' A' ' 579' ' ' ARG . 14.4 m120 -59.64 -51.56 69.28 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.576 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -60.33 -39.51 87.31 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.045 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -61.27 -48.12 82.87 Favored 'General case' 0 CA--C 1.508 -0.666 0 O-C-N 123.531 0.519 . . . . 0.0 110.483 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 96.1 mt -57.74 -48.55 79.3 Favored 'General case' 0 CA--C 1.516 -0.33 0 O-C-N 123.663 0.602 . . . . 0.0 109.984 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.462 ' HG3' ' O ' ' A' ' 575' ' ' ASN . 98.4 mtt180 -60.17 -57.85 11.04 Favored 'General case' 0 C--O 1.182 -2.48 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.667 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -70.45 -34.33 72.32 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -66.1 -56.48 11.28 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.001 0.905 . . . . 0.0 110.382 175.596 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 582' ' ' THR . . . . . . . . . . . . . 3.6 m -68.39 -21.34 64.7 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 126.084 1.753 . . . . 0.0 111.843 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 591' ' ' LYS . 67.9 ttt180 -24.22 -59.86 0.05 Allowed 'General case' 0 CA--C 1.479 -1.752 0 C-N-CA 130.57 3.548 . . . . 0.0 117.587 -163.087 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.501 ' HB ' ' HA ' ' A' ' 587' ' ' VAL . 46.7 pt -84.62 -52.62 12.3 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.535 0 C-N-CA 116.99 -1.884 . . . . 0.0 112.752 -175.583 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 65.59 -57.37 0.13 Allowed Glycine 0 CA--C 1.548 2.128 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 -170.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 586' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 20.2 t70 -144.36 115.64 8.0 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 103.725 -2.695 . . . . 0.0 103.725 172.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.501 ' HA ' ' HB ' ' A' ' 584' ' ' ILE 0.349 11.2 p -30.14 -87.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.575 1.911 0 N-CA-C 118.555 2.798 . . . . 0.0 118.555 -163.809 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.515 ' O ' ' HG2' ' A' ' 591' ' ' LYS . 69.8 mm-40 -69.66 -62.03 1.55 Allowed 'General case' 0 C--O 1.268 2.029 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 -170.909 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 41.9 tp -67.27 -52.21 43.53 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.416 -170.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 590' ' ' GLN . . . . . 0.434 ' HB3' ' O ' ' A' ' 586' ' ' ASP . 57.3 tp60 -64.48 -34.41 78.14 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-O 118.408 -0.806 . . . . 0.0 112.586 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.515 ' HG2' ' O ' ' A' ' 588' ' ' GLU . 21.4 pttm -60.23 -39.13 85.56 Favored 'General case' 0 C--N 1.374 1.658 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.705 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -59.39 -55.03 39.82 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.502 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -63.94 -41.01 97.73 Favored 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.442 ' O ' HG23 ' A' ' 598' ' ' VAL . 3.5 tm? -57.22 -50.96 71.24 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 122.426 0.29 . . . . 0.0 110.857 -177.739 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -30.65 70.39 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.381 -178.046 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 7.9 tp60 -66.15 -50.48 63.82 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.964 176.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 1.7 mp -56.05 -50.0 72.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.436 177.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 598' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 594' ' ' LEU . 26.1 t -66.5 -33.03 60.76 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.259 0 CA-C-O 120.917 0.389 . . . . 0.0 111.123 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -65.77 -45.23 83.26 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.903 0.382 . . . . 0.0 110.382 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.09 -32.96 74.73 Favored 'General case' 0 C--O 1.214 -0.787 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.203 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -63.15 -40.04 96.41 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.657 0.741 . . . . 0.0 109.408 175.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 602' ' ' LYS . . . . . . . . . . . . . 12.0 tmtt? -68.75 -47.89 65.11 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.825 -1.079 . . . . 0.0 110.92 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -75.08 -7.63 54.27 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 178.082 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -67.14 -40.18 86.68 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 175.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 24.9 ttt . . . . . 0 C--O 1.253 1.266 0 O-C-N 124.791 1.307 . . . . 0.0 111.074 175.524 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -86.03 108.83 18.42 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.112 -1.069 . . . . 0.0 108.112 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -88.17 65.71 8.22 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 122.055 0.931 . . . . 0.0 110.604 -176.824 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 466' ' ' LEU . . . . . 0.533 HD12 ' O ' ' A' ' 466' ' ' LEU . 3.2 pp -74.98 107.64 7.18 Favored 'General case' 0 N--CA 1.417 -2.091 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.156 169.171 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 467' ' ' SER . . . . . 0.52 ' HB2' ' OE1' ' A' ' 469' ' ' GLN . 4.0 p -109.64 162.86 14.02 Favored 'General case' 0 C--N 1.279 -2.496 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -176.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 468' ' ' ARG . . . . . 0.549 ' O ' ' HB2' ' A' ' 471' ' ' LYS . 4.3 ptp180 -64.93 -18.08 64.92 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.252 0.548 . . . . 0.0 112.076 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.52 ' OE1' ' HB2' ' A' ' 467' ' ' SER . 26.3 mp0 -65.15 -27.23 68.57 Favored 'General case' 0 C--N 1.31 -1.122 0 O-C-N 122.072 -0.393 . . . . 0.0 111.922 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.442 ' HA ' ' OE1' ' A' ' 473' ' ' GLU . 2.3 mp0 -67.02 -25.46 66.3 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 120.983 0.421 . . . . 0.0 111.274 173.289 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.549 ' HB2' ' O ' ' A' ' 468' ' ' ARG . 16.6 mmtp -67.94 -41.1 83.07 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 173.397 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -65.23 -46.24 81.45 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.368 178.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 473' ' ' GLU . . . . . 0.579 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 50.1 mt-10 -54.28 -58.46 7.3 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 175.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 41.3 ttt-85 -51.37 -35.26 37.75 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 475' ' ' ALA . . . . . 0.624 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -62.27 -51.85 66.08 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -63.51 -44.34 94.59 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.71 0.767 . . . . 0.0 112.056 176.17 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 61.2 mt -73.4 -9.02 58.26 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 -173.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.624 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 24.7 pttm -74.38 -0.6 17.79 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.596 -0.69 . . . . 0.0 112.164 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.411 ' HB2' ' OD1' ' A' ' 483' ' ' ASP . 6.2 p80 -142.75 108.76 5.19 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 124.118 0.967 . . . . 0.0 108.81 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.519 HD13 HD21 ' A' ' 511' ' ' LEU . 93.0 mt -138.04 8.03 2.71 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -172.904 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 82.9 mtp -94.49 -66.16 0.93 Allowed 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 119.714 -0.795 . . . . 0.0 111.743 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -71.9 -29.15 64.03 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 122.685 1.231 . . . . 0.0 109.862 177.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 483' ' ' ASP . . . . . 0.537 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 9.3 m-20 -71.11 51.52 0.16 Allowed 'General case' 0 C--N 1.288 -2.091 0 C-N-CA 127.834 2.453 . . . . 0.0 115.424 -172.624 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -66.19 -39.61 89.83 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -55.26 -46.05 76.12 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-N 114.045 -1.434 . . . . 0.0 109.538 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.537 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 23.5 m -65.53 -40.98 93.55 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 123.494 0.718 . . . . 0.0 111.774 -177.506 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 487' ' ' PHE . . . . . 0.406 ' CE2' ' HE1' ' A' ' 491' ' ' TYR . 37.8 t80 -60.49 -47.65 85.23 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.474 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 4.2 mm? -69.05 -31.57 70.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.904 178.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -72.11 -23.82 61.39 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.268 0.556 . . . . 0.0 110.145 177.317 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -83.48 -23.69 32.09 Favored 'General case' 0 N--CA 1.388 -3.555 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 491' ' ' TYR . . . . . 0.474 ' HB2' ' O ' ' A' ' 488' ' ' LEU . 28.9 m-85 -62.2 -42.38 99.24 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 167.625 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -70.84 -44.18 67.0 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.21 -0.905 . . . . 0.0 111.556 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 19.8 m -78.33 -8.87 58.92 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -174.712 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 87.4 t -122.17 107.83 20.58 Favored 'Isoleucine or valine' 0 C--O 1.249 1.04 0 CA-C-O 121.14 0.495 . . . . 0.0 110.753 -177.533 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . 0.272 6.9 p30 -150.67 -84.04 0.09 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 178.687 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.447 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 4.0 mptp? -76.73 -13.91 59.99 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.801 0.81 . . . . 0.0 112.059 -177.424 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -72.46 23.91 0.05 Allowed 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 125.977 1.711 . . . . 0.0 111.533 173.415 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 498' ' ' ASN . . . . . 0.427 ' H ' ' C ' ' A' ' 496' ' ' LYS . 4.2 p-10 -77.72 18.08 0.49 Allowed 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 123.722 0.809 . . . . 0.0 112.092 -176.079 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 499' ' ' PHE . . . . . 0.418 ' CE1' ' HD3' ' A' ' 566' ' ' LYS . 23.4 p90 -77.79 -22.56 49.94 Favored 'General case' 0 C--O 1.244 0.809 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 175.251 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 500' ' ' THR . . . . . 0.525 ' HB ' ' CE2' ' A' ' 504' ' ' PHE . 3.9 m -67.48 156.57 36.31 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.088 -1.414 . . . . 0.0 109.56 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.517 ' C ' ' H ' ' A' ' 503' ' ' HIS . 28.4 t-20 -65.72 164.36 14.7 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 124.496 1.118 . . . . 0.0 111.866 -175.372 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 502' ' ' GLN . . . . . 0.519 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 7.8 pt20 -58.6 14.32 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 127.201 2.2 . . . . 0.0 113.85 177.731 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 503' ' ' HIS . . . . . 0.517 ' H ' ' C ' ' A' ' 501' ' ' ASN . 7.8 t-160 -64.3 -55.47 21.13 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -174.323 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 504' ' ' PHE . . . . . 0.525 ' CE2' ' HB ' ' A' ' 500' ' ' THR . 0.1 OUTLIER -61.18 -24.18 66.12 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.141 -1.39 . . . . 0.0 114.069 174.824 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.519 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 45.3 tttp -62.14 -52.07 65.31 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.499 ' O ' HG23 ' A' ' 510' ' ' VAL 0.319 2.8 m-85 -69.12 -29.68 67.79 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 178.524 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 507' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 503' ' ' HIS . 82.2 t -63.25 -53.7 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.793 175.353 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -50.09 -53.88 24.23 Favored 'General case' 0 C--O 1.2 -1.536 0 O-C-N 123.166 0.291 . . . . 0.0 111.22 175.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -57.63 -60.05 4.26 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.941 1.46 . . . . 0.0 114.941 -176.737 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 506' ' ' TYR . 10.9 t -61.81 -43.38 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.478 -176.381 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.519 HD21 HD13 ' A' ' 480' ' ' LEU . 10.4 mp -66.64 -49.13 67.24 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.753 -177.623 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -61.74 -46.92 87.54 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 123.358 0.663 . . . . 0.0 110.047 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -55.88 -48.67 75.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.951 0.5 . . . . 0.0 111.722 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -70.82 -45.14 65.12 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.94 -178.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -52.59 -39.59 61.75 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 124.772 1.229 . . . . 0.0 109.434 175.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -64.63 -21.37 66.7 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.046 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -106.55 -56.46 2.19 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 121.056 0.455 . . . . 0.0 111.141 -178.84 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -117.58 -154.41 0.56 Allowed 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -173.158 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 519' ' ' ASP . . . . . 0.422 ' CG ' ' H ' ' A' ' 520' ' ' GLN . 16.9 t70 -87.22 -159.82 0.54 Allowed 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 125.849 1.659 . . . . 0.0 107.984 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 520' ' ' GLN . . . . . 0.422 ' H ' ' CG ' ' A' ' 519' ' ' ASP . 77.4 mm-40 -79.22 155.28 28.67 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -170.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -41.88 134.2 2.67 Favored 'General case' 0 N--CA 1.407 -2.597 0 C-N-CA 128.025 2.53 . . . . 0.0 116.255 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 80.8 m-20 -118.1 158.49 24.93 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 106.308 -1.738 . . . . 0.0 106.308 173.196 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 45.3 pt -68.48 -23.37 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-O 121.583 0.706 . . . . 0.0 109.417 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.442 ' HA ' HG12 ' A' ' 527' ' ' VAL . 3.0 m -56.35 -40.06 73.87 Favored 'General case' 0 N--CA 1.417 -2.109 0 C-N-CA 125.166 1.386 . . . . 0.0 110.891 177.566 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 525' ' ' ASP . . . . . 0.425 ' O ' ' HB3' ' A' ' 528' ' ' GLN . 15.9 m-20 -68.4 -33.88 75.02 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.328 0.585 . . . . 0.0 110.4 179.347 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -64.18 -47.89 78.07 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.642 177.235 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.442 HG12 ' HA ' ' A' ' 524' ' ' SER . 7.6 p -70.86 -18.22 20.72 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.106 0 CA-C-O 121.77 0.795 . . . . 0.0 110.374 176.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 528' ' ' GLN . . . . . 0.425 ' HB3' ' O ' ' A' ' 525' ' ' ASP . 0.7 OUTLIER -68.17 -31.58 71.23 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 172.58 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.63 ' HB3' ' HG3' ' A' ' 536' ' ' ARG . 0.5 OUTLIER -85.21 11.38 10.07 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.764 175.223 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.56 ' HA ' ' CZ ' ' A' ' 536' ' ' ARG . 2.9 p -72.94 4.98 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -171.572 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -109.0 -35.99 6.2 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 119.948 -1.72 . . . . 0.0 110.749 176.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 532' ' ' SER . . . . . 0.589 ' O ' ' HG3' ' A' ' 534' ' ' GLU . 24.5 t -80.44 -145.2 0.05 OUTLIER 'General case' 0 CA--C 1.583 2.221 0 CA-C-N 114.474 -1.239 . . . . 0.0 110.342 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 533' ' ' ASN . . . . . 0.465 ' O ' ' N ' ' A' ' 535' ' ' LEU 0.574 5.3 t-20 -25.34 39.02 0.0 OUTLIER 'General case' 0 CA--C 1.465 -2.325 1 C-N-CA 137.084 6.154 . . . . 0.0 121.61 179.905 . . . . . . . . 4 3 . 1 . 011 nuclear build full ' A' A ' 534' ' ' GLU . . . . . 0.746 ' HA ' ' HD3' ' A' ' 536' ' ' ARG . 45.9 mt-10 -28.97 6.41 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.813 0 C-N-CA 129.19 2.996 . . . . 0.0 117.384 -177.592 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.465 ' N ' ' O ' ' A' ' 533' ' ' ASN . 1.0 OUTLIER -72.06 -21.48 61.51 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 162.411 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.746 ' HD3' ' HA ' ' A' ' 534' ' ' GLU . 0.0 OUTLIER -69.59 -18.26 63.6 Favored 'General case' 0 C--N 1.383 2.052 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 172.222 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 537' ' ' GLU . . . . . 0.51 ' N ' ' HD3' ' A' ' 536' ' ' ARG . 6.1 tp10 -76.95 -41.26 43.96 Favored 'General case' 0 CA--C 1.47 -2.117 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 -178.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.459 ' O ' HD13 ' A' ' 542' ' ' LEU . 27.6 m -54.96 -47.64 74.26 Favored 'General case' 0 N--CA 1.442 -0.873 0 O-C-N 124.05 0.844 . . . . 0.0 108.849 172.352 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 59.5 tp -56.48 -48.18 77.68 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.267 177.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 540' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 536' ' ' ARG . 57.5 mt -63.72 -41.08 91.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-O 120.744 0.307 . . . . 0.0 110.729 178.603 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.2 m -56.99 -46.44 82.24 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.684 0.754 . . . . 0.0 109.993 174.331 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 538' ' ' THR . 6.0 mp -67.53 -16.15 64.04 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 124.43 1.092 . . . . 0.0 112.652 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -88.26 -39.85 14.11 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 177.099 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -67.09 -36.78 82.71 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -68.27 129.18 39.16 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 170.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -74.95 109.06 8.09 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 122.382 1.087 . . . . 0.0 112.189 -168.531 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 547' ' ' LEU . 1.0 OUTLIER -78.96 -13.93 59.51 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 113.3 -1.773 . . . . 0.0 113.505 -177.215 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -75.94 -6.98 53.48 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.114 0.483 . . . . 0.0 110.666 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -72.59 -8.33 54.67 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.888 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -87.69 149.02 45.25 Favored Pre-proline 0 C--N 1.312 -1.054 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 551' ' ' PRO . . . . . 0.42 ' O ' ' HB2' ' A' ' 554' ' ' ASN . 23.2 Cg_exo -66.84 129.43 20.87 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.035 1.823 . . . . 0.0 107.99 172.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 552' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 555' ' ' GLU . 21.6 t80 -82.84 -6.09 59.28 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 121.937 0.875 . . . . 0.0 111.23 -172.313 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -82.88 -8.63 59.56 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-O 121.773 0.797 . . . . 0.0 111.502 172.198 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 554' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 551' ' ' PRO . 6.6 m-20 -73.04 -22.89 60.55 Favored 'General case' 0 C--O 1.198 -1.622 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.357 177.076 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 555' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 552' ' ' TYR . 18.6 mm-40 -40.0 -83.65 0.01 OUTLIER 'General case' 0 C--O 1.196 -1.73 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -164.079 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 556' ' ' ILE . . . . . 0.473 ' H ' HD12 ' A' ' 556' ' ' ILE . 0.6 OUTLIER -67.59 -39.27 82.0 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-O 121.573 0.701 . . . . 0.0 110.037 -176.722 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.88 -59.81 4.85 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.341 -173.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -73.83 -39.25 64.17 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.147 -176.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 559' ' ' TYR . . . . . 0.516 ' O ' HG13 ' A' ' 563' ' ' ILE . 93.5 t80 -50.34 -53.34 29.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.257 1.023 . . . . 0.0 111.018 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.4 t -64.69 -40.35 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.768 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.446 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 2.4 t-20 -59.04 -45.92 89.52 Favored 'General case' 0 C--O 1.194 -1.833 0 CA-C-O 119.331 -0.366 . . . . 0.0 110.58 175.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 562' ' ' VAL . . . . . 0.499 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 91.2 t -66.17 -33.15 61.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 559' ' ' TYR . 14.4 mt -87.09 -31.74 6.12 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.983 0 C-N-CA 118.205 -1.398 . . . . 0.0 108.907 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 564' ' ' ASN . . . . . 0.416 ' HB3' ' HB ' ' A' ' 571' ' ' ILE . 78.5 m-20 -83.53 -2.25 55.56 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.638 176.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.499 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 11.4 tp10 -73.6 -11.17 60.34 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 113.761 -1.563 . . . . 0.0 107.462 175.21 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 566' ' ' LYS . . . . . 0.418 ' HD3' ' CE1' ' A' ' 499' ' ' PHE . 38.4 ttpt -56.87 -35.11 68.53 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.047 172.976 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -113.66 -55.75 0.42 Allowed Glycine 0 N--CA 1.435 -1.379 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.934 -178.047 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 568' ' ' GLN . . . . . 0.429 ' HA ' ' CD ' ' A' ' 572' ' ' GLU . 8.7 tt0 55.7 90.92 0.03 OUTLIER 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.781 0.832 . . . . 0.0 110.427 -173.525 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -170.54 -34.87 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.67 -174.165 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 76.8 m -166.91 -19.08 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.168 0 CA-C-O 121.739 0.78 . . . . 0.0 110.854 -168.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.416 ' HB ' ' HB3' ' A' ' 564' ' ' ASN . 0.0 OUTLIER -86.35 -19.44 8.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.268 0 CA-C-O 122.191 0.996 . . . . 0.0 109.14 -171.228 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 572' ' ' GLU . . . . . 0.429 ' CD ' ' HA ' ' A' ' 568' ' ' GLN . 1.5 mp0 -71.1 -12.8 61.7 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.112 174.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 573' ' ' SER . . . . . 0.494 ' O ' ' HB2' ' A' ' 576' ' ' HIS . 22.5 t -62.99 -25.95 68.62 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 107.667 -1.235 . . . . 0.0 107.667 172.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.416 ' O ' ' HG ' ' A' ' 578' ' ' LEU . 9.3 mp -63.5 -32.86 74.43 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 121.017 0.437 . . . . 0.0 110.634 172.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 575' ' ' ASN . . . . . 0.413 ' HA ' HD12 ' A' ' 578' ' ' LEU . 2.8 t-20 -64.19 -34.73 78.76 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 121.657 0.741 . . . . 0.0 109.626 174.841 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 576' ' ' HIS . . . . . 0.494 ' HB2' ' O ' ' A' ' 573' ' ' SER . 9.3 m80 -60.72 -44.88 96.08 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.388 175.163 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -57.18 -47.81 80.31 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.854 176.203 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.437 ' O ' ' HB ' ' A' ' 582' ' ' THR . 89.1 mt -52.84 -45.08 67.19 Favored 'General case' 0 CA--C 1.492 -1.288 0 C-N-CA 123.231 0.612 . . . . 0.0 111.105 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.668 ' O ' ' HG2' ' A' ' 583' ' ' ARG . 0.0 OUTLIER -59.48 -57.16 14.2 Favored 'General case' 0 C--O 1.199 -1.556 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.35 179.313 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 580' ' ' GLU . . . . . 0.45 ' HG3' ' NH2' ' A' ' 579' ' ' ARG . 15.0 tt0 -73.41 -36.04 65.93 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -170.452 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -68.05 -46.21 71.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-O 121.472 0.654 . . . . 0.0 110.837 175.122 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.437 ' HB ' ' O ' ' A' ' 578' ' ' LEU . 84.9 m -88.71 -40.55 13.17 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 119.543 3.164 . . . . 0.0 119.543 -170.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' A' ' 579' ' ' ARG . 0.6 OUTLIER -43.21 -85.19 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 -159.1 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.549 ' C ' ' H ' ' A' ' 586' ' ' ASP . 12.8 pt -121.64 -17.33 5.63 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.873 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -174.164 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 74.13 -37.98 0.96 Allowed Glycine 0 CA--C 1.573 3.684 0 CA-C-O 122.468 1.038 . . . . 0.0 110.908 -166.41 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 586' ' ' ASP . . . . . 0.549 ' H ' ' C ' ' A' ' 584' ' ' ILE . 23.9 t70 -72.68 173.73 8.6 Favored 'General case' 0 C--O 1.194 -1.855 0 C-N-CA 131.63 3.972 . . . . 0.0 107.745 174.456 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.478 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 7.5 p -27.03 23.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.61 3.263 1 C-N-CA 132.85 4.46 . . . . 0.0 118.675 -174.796 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.536 ' HA ' ' HB2' ' A' ' 591' ' ' LYS 0.352 12.9 pt-20 -55.05 7.41 0.01 OUTLIER 'General case' 0 C--N 1.262 -3.209 0 N-CA-C 117.468 2.396 . . . . 0.0 117.468 179.465 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 589' ' ' LEU . . . . . 0.577 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 59.0 tp -71.5 -41.33 69.42 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 162.494 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 590' ' ' GLN . . . . . 0.478 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 0.1 OUTLIER -55.07 -49.73 70.93 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 105.165 -2.161 . . . . 0.0 105.165 167.215 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.665 ' O ' ' HB3' ' A' ' 594' ' ' LEU 0.252 33.6 mmtp -72.95 -9.05 58.3 Favored 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 177.555 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 592' ' ' TYR . . . . . 0.577 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 82.0 t80 -63.26 -39.56 94.94 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 170.426 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -54.74 -39.43 68.29 Favored 'General case' 0 CA--C 1.553 1.094 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.164 171.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.665 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 10.2 tp -54.31 -46.25 72.78 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 121.57 0.7 . . . . 0.0 109.463 175.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.456 ' HB2' ' HD3' ' A' ' 579' ' ' ARG . 23.7 tt0 -60.82 -37.48 82.16 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 114.253 -1.339 . . . . 0.0 110.999 -176.23 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 596' ' ' GLN . . . . . 0.489 ' O ' ' HD3' ' A' ' 600' ' ' LYS . 82.0 mm-40 -63.45 -47.87 80.06 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 175.334 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 84.8 mt -54.12 -52.64 35.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.262 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 97.9 t -63.99 -47.37 90.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.421 ' O ' ' HG2' ' A' ' 603' ' ' GLU . . . -61.23 -41.38 96.77 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 118.296 0.498 . . . . 0.0 110.523 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 600' ' ' LYS . . . . . 0.489 ' HD3' ' O ' ' A' ' 596' ' ' GLN . 1.4 mptm? -67.18 -37.92 84.51 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.029 176.546 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 601' ' ' ASN . . . . . 0.414 ' HA ' ' HB3' ' A' ' 604' ' ' ARG . 99.0 m-20 -71.81 -21.97 61.63 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 177.253 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 602' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.73 -47.97 56.92 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 123.635 0.774 . . . . 0.0 109.451 177.514 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 603' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 599' ' ' ALA . 4.7 pt-20 -75.72 -19.62 58.95 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.757 0.789 . . . . 0.0 110.477 177.773 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 604' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 600' ' ' LYS . 75.8 ttt180 -77.74 -8.69 58.33 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.01 0.924 . . . . 0.0 109.691 178.142 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 15.2 tpt . . . . . 0 C--N 1.309 -1.175 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -177.443 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 . . . . . 0 C--O 1.241 0.628 0 CA-C-O 120.793 0.33 . . . . 0.0 110.794 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -81.15 163.65 22.94 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -133.98 83.82 2.07 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -178.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 89.8 mt -63.13 120.93 12.41 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.763 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 37.0 t -88.95 106.57 18.5 Favored 'General case' 0 N--CA 1.421 -1.906 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -66.96 -36.93 83.31 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.432 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 26.8 mp0 -68.23 -45.11 74.17 Favored 'General case' 0 C--O 1.198 -1.644 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.743 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -66.26 -22.85 66.32 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -177.262 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.408 ' HD3' ' C ' ' A' ' 471' ' ' LYS . 10.1 tmtt? -76.9 -37.39 55.54 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 172.738 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 472' ' ' ALA . . . . . 0.578 ' HB3' HD11 ' A' ' 563' ' ' ILE . . . -64.22 -51.82 61.81 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.31 178.273 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 473' ' ' GLU . . . . . 0.569 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 2.2 mp0 -53.42 -43.1 67.71 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 118.079 0.4 . . . . 0.0 110.961 176.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 61.5 mtt85 -53.82 -41.95 67.91 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 120.853 0.359 . . . . 0.0 111.183 172.447 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 475' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' A' ' 478' ' ' LYS . . . -71.23 -28.56 64.28 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 122.965 0.506 . . . . 0.0 112.317 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -35.06 79.68 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.663 -0.648 . . . . 0.0 110.171 176.396 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 45.9 mt -64.05 -8.99 13.56 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 124.61 1.164 . . . . 0.0 112.178 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.477 ' HB3' ' O ' ' A' ' 475' ' ' ALA . 80.3 tttt -71.31 -3.96 23.44 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.656 1.582 . . . . 0.0 111.804 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.488 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 16.9 m170 -96.58 152.47 18.61 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 7.9 mp -122.34 -63.99 1.24 Allowed 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 64.0 mtt -95.21 -57.39 2.43 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -171.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -67.77 -12.7 61.11 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 483' ' ' ASP . . . . . 0.488 ' HB2' ' HB3' ' A' ' 479' ' ' HIS . 26.2 t70 -75.07 8.36 2.64 Favored 'General case' 0 C--O 1.184 -2.379 0 C-N-CA 124.572 1.149 . . . . 0.0 113.13 -175.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -46.72 -61.81 1.67 Allowed 'General case' 0 C--O 1.275 2.395 0 C-N-CA 124.113 0.965 . . . . 0.0 112.682 -174.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -62.84 -43.14 99.59 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.631 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 28.1 m -60.81 -41.79 96.37 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.468 -177.105 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 487' ' ' PHE . . . . . 0.517 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 39.0 t80 -59.7 -47.12 86.9 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 123.061 0.544 . . . . 0.0 109.843 175.368 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 70.9 mt -66.04 -34.55 78.34 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.463 0.649 . . . . 0.0 110.533 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -67.15 -49.11 65.94 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.711 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 490' ' ' TYR . . . . . 0.496 ' CZ ' ' HE1' ' A' ' 559' ' ' TYR . 1.3 m-85 -76.96 -8.64 57.74 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 491' ' ' TYR . . . . . 0.517 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.4 OUTLIER -74.55 -52.39 12.0 Favored 'General case' 0 C--N 1.286 -2.185 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.689 176.348 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.17 -27.86 38.9 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -174.486 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 19.7 p -81.67 -24.42 36.29 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -176.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 50.6 t -96.68 156.24 3.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.086 0.47 . . . . 0.0 110.445 -175.653 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -85.91 124.44 32.38 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -176.78 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.56 ' HA ' ' OG1' ' A' ' 500' ' ' THR . 62.3 pttt -88.75 -15.82 33.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.13 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -69.6 -70.93 0.25 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -175.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -106.9 -31.74 8.21 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.502 -174.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -72.66 -37.35 67.97 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.67 -175.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 500' ' ' THR . . . . . 0.56 ' OG1' ' HA ' ' A' ' 496' ' ' LYS . 76.1 m -71.66 102.45 2.78 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.887 0.851 . . . . 0.0 112.496 -179.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -77.13 163.16 26.85 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.32 -1.309 . . . . 0.0 107.773 174.418 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -53.97 -34.84 60.89 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.966 0.803 . . . . 0.0 110.566 179.146 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -57.15 -56.11 25.97 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.981 175.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -66.13 -30.53 71.04 Favored 'General case' 0 CA--C 1.556 1.195 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.736 -178.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -67.3 -47.71 69.77 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 124.12 0.968 . . . . 0.0 110.072 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.558 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -59.74 -45.91 90.75 Favored 'General case' 0 N--CA 1.425 -1.694 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.869 -178.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 11.8 p -68.28 -40.96 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 O-C-N 123.428 0.455 . . . . 0.0 111.049 -176.664 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -51.28 -53.92 31.0 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.079 0.466 . . . . 0.0 110.558 173.413 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.37 -41.85 98.95 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.992 -1.004 . . . . 0.0 113.521 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 506' ' ' TYR . 95.7 t -57.55 -52.45 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 CA-C-O 120.889 0.376 . . . . 0.0 110.814 176.769 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.5 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 10.2 mp -66.37 -38.69 88.13 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.949 -177.694 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -62.99 -49.2 75.61 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.629 0.58 . . . . 0.0 109.555 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -52.64 -51.29 60.73 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.677 0.791 . . . . 0.0 110.75 -179.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -64.11 -53.36 50.87 Favored 'General case' 0 C--O 1.187 -2.223 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.747 177.416 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 515' ' ' TYR . . . . . 0.5 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 3.6 t80 -52.0 -35.7 47.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.976 0.91 . . . . 0.0 110.968 -177.006 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.41 -25.26 62.26 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -117.28 -38.2 3.39 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.778 0.799 . . . . 0.0 111.951 -177.572 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -124.82 -153.09 0.54 Allowed 'General case' 0 C--N 1.285 -2.233 0 C-N-CA 124.802 1.241 . . . . 0.0 109.16 -171.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -85.2 -162.01 0.66 Allowed 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 520' ' ' GLN . . . . . 0.463 ' HG2' ' H ' ' A' ' 521' ' ' TYR . 8.3 tt0 -82.36 -169.74 2.58 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -177.474 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 521' ' ' TYR . . . . . 0.463 ' H ' ' HG2' ' A' ' 520' ' ' GLN . 13.0 t80 -45.43 130.78 8.52 Favored 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 125.48 1.512 . . . . 0.0 114.266 -174.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -118.14 134.41 55.03 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 178.213 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 1.7 tt -53.72 -26.26 13.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 125.441 1.496 . . . . 0.0 112.029 179.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 48.1 t -54.34 -38.61 66.23 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 122.749 0.42 . . . . 0.0 111.548 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 525' ' ' ASP . . . . . 0.53 ' O ' ' HB3' ' A' ' 528' ' ' GLN . 2.8 t70 -72.04 -36.91 69.77 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -58.13 -55.53 33.77 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.132 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.445 ' O ' HG12 ' A' ' 530' ' ' VAL . 14.7 p -66.98 -18.84 24.84 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 CA-C-O 121.498 0.666 . . . . 0.0 111.423 179.296 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 528' ' ' GLN . . . . . 0.53 ' HB3' ' O ' ' A' ' 525' ' ' ASP . 48.1 tt0 -65.8 -37.75 87.1 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 171.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.444 ' C ' ' H ' ' A' ' 531' ' ' ASN . 76.8 m-85 -79.8 9.48 5.16 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 176.982 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 527' ' ' VAL . 5.3 p -74.3 16.84 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 CA-C-O 122.413 1.102 . . . . 0.0 110.794 178.519 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 531' ' ' ASN . . . . . 0.444 ' H ' ' C ' ' A' ' 529' ' ' TYR . 91.2 m-20 -111.03 -29.57 7.84 Favored 'General case' 0 C--N 1.288 -2.079 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.021 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 12.9 m -81.2 158.52 24.86 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.696 -177.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 533' ' ' ASN . . . . . 0.48 ' O ' ' HG3' ' A' ' 537' ' ' GLU . 27.0 t-20 -65.97 -73.55 0.13 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -177.839 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -71.93 -32.33 67.23 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -172.07 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.409 ' H ' HD22 ' A' ' 535' ' ' LEU . 2.5 mm? -66.08 -38.53 88.52 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -178.314 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 11.6 ttm180 -64.4 -56.41 14.48 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 175.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 537' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 533' ' ' ASN . 42.4 mt-10 -55.83 -70.19 0.12 Allowed 'General case' 0 C--N 1.347 0.468 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.186 -177.771 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 8.9 m -64.31 -54.56 31.15 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -172.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 48.8 tp -63.99 -44.27 93.18 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.013 -173.069 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 540' ' ' ILE . . . . . 0.586 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 64.8 mt -69.27 -28.23 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.728 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 541' ' ' SER . . . . . 0.47 ' HB2' ' O ' ' A' ' 537' ' ' GLU . 9.0 t -57.43 -44.32 84.57 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 174.184 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.515 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 3.1 mm? -67.47 -23.53 65.51 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 176.183 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 543' ' ' GLU . . . . . 0.45 ' C ' ' H ' ' A' ' 545' ' ' TYR . 36.6 tt0 -76.63 -26.61 55.1 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 121.349 0.595 . . . . 0.0 109.773 174.628 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 544' ' ' GLN . . . . . 0.586 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 86.2 mt-30 -80.87 31.86 0.31 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 124.11 0.964 . . . . 0.0 110.368 177.268 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 545' ' ' TYR . . . . . 0.515 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 6.3 p90 -68.09 166.92 15.04 Favored 'General case' 0 N--CA 1.394 -3.27 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.792 -175.559 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -79.22 156.0 28.35 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 121.688 0.756 . . . . 0.0 112.304 -170.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' A' ' 549' ' ' ASP . 3.0 mm? -77.23 6.04 7.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.102 -177.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 89.7 m-20 -79.39 21.9 0.46 Allowed 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 125.162 1.385 . . . . 0.0 110.072 177.055 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 549' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 547' ' ' LEU . 3.2 p-10 -67.36 0.5 2.85 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -172.506 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -61.96 140.65 95.73 Favored Pre-proline 0 C--N 1.324 -0.528 0 N-CA-C 104.905 -2.257 . . . . 0.0 104.905 170.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -0.64 66.34 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.094 1 C-N-CA 126.555 4.836 . . . . 0.0 115.532 -167.139 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -89.89 19.98 4.47 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 122.921 1.343 . . . . 0.0 109.76 -171.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 553' ' ' GLU . . . . . 0.418 ' H ' ' HG2' ' A' ' 553' ' ' GLU . 8.7 pt-20 -71.97 -4.6 29.44 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-N 113.577 -1.647 . . . . 0.0 110.854 177.411 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 554' ' ' ASN . . . . . 0.613 ' HA ' ' OD2' ' A' ' 557' ' ' ASP . 14.2 m120 -66.56 -23.07 66.16 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.29 172.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.01 -34.06 72.83 Favored 'General case' 0 C--O 1.21 -1.002 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 175.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 57.0 mt -76.45 -39.92 34.07 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.052 0 C-N-CA 124.123 0.969 . . . . 0.0 109.015 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 557' ' ' ASP . . . . . 0.613 ' OD2' ' HA ' ' A' ' 554' ' ' ASN . 20.1 m-20 -54.82 -54.15 46.02 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-O 121.759 0.79 . . . . 0.0 108.908 174.444 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.21 -50.66 70.62 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 113.538 -1.665 . . . . 0.0 109.564 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 559' ' ' TYR . . . . . 0.619 ' O ' HG12 ' A' ' 563' ' ' ILE . 52.5 t80 -56.14 -55.07 37.57 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 124.721 1.208 . . . . 0.0 111.304 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 75.6 t -64.97 -37.26 79.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.032 -174.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.4 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 4.1 t-20 -61.43 -41.04 96.55 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 176.125 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 562' ' ' VAL . . . . . 0.597 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 78.1 t -72.46 -40.47 63.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 C-N-CA 123.859 0.864 . . . . 0.0 113.175 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.619 HG12 ' O ' ' A' ' 559' ' ' TYR . 28.5 mm -89.02 -49.02 14.41 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.906 0 CA-C-O 122.03 0.919 . . . . 0.0 109.519 -170.031 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -77.49 3.5 13.32 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.559 -175.99 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 6.0 pt-20 -75.47 -23.18 56.82 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 174.742 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -84.27 7.37 19.44 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.421 178.236 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -79.69 63.69 3.97 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 175.952 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -75.36 36.68 0.12 Allowed 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 126.369 1.868 . . . . 0.0 111.58 -175.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -82.09 -71.67 0.47 Allowed 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -163.37 156.78 19.24 Favored 'General case' 0 C--O 1.252 1.201 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.106 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 28.2 mm -45.7 -52.51 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 O-C-N 125.056 1.473 . . . . 0.0 110.451 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -68.77 -30.59 69.22 Favored 'General case' 0 N--CA 1.415 -2.219 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -173.566 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 14.8 m -68.69 -42.98 77.04 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.527 ' O ' ' HG ' ' A' ' 578' ' ' LEU . 0.7 OUTLIER -58.76 -49.09 78.93 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 112.983 -1.917 . . . . 0.0 109.296 175.862 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -58.72 -55.43 35.25 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.209 1.004 . . . . 0.0 111.464 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -55.27 -47.07 76.03 Favored 'General case' 0 CA--C 1.498 -1.04 0 O-C-N 123.736 0.648 . . . . 0.0 111.363 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -65.02 -47.56 77.04 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 574' ' ' LEU . 91.2 mt -61.04 -62.68 1.68 Allowed 'General case' 0 C--O 1.251 1.178 0 CA-C-O 122.28 1.038 . . . . 0.0 111.004 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 579' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -59.74 -56.53 20.62 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 113.663 -1.608 . . . . 0.0 113.128 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 580' ' ' GLU . . . . . 0.568 ' O ' ' HG2' ' A' ' 583' ' ' ARG . 28.0 mt-10 -74.64 -35.32 62.87 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 -170.974 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -63.38 -45.75 89.66 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.994 -0.682 . . . . 0.0 110.896 177.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 582' ' ' THR . . . . . . . . . . . . . 4.0 m -71.15 -25.68 62.66 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.325 -0.852 . . . . 0.0 113.022 -178.321 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.568 ' HG2' ' O ' ' A' ' 580' ' ' GLU . 18.5 ptt180 -48.44 -16.79 0.12 Allowed 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -174.25 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 44.1 pt -78.93 34.33 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 CA-C-O 121.757 0.789 . . . . 0.0 110.945 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 129.7 56.68 0.1 Allowed Glycine 0 CA--C 1.493 -1.32 0 N-CA-C 108.777 -1.729 . . . . 0.0 108.777 -178.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 586' ' ' ASP . . . . . 0.555 ' C ' ' H ' ' A' ' 588' ' ' GLU . 23.2 t0 -87.45 142.28 27.99 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 122.203 1.002 . . . . 0.0 113.228 -173.21 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 6.7 t -68.38 22.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.545 0 C-N-CA 129.874 3.269 . . . . 0.0 109.591 173.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.675 ' O ' ' HB2' ' A' ' 592' ' ' TYR . 9.2 pt-20 -39.8 -10.73 0.01 OUTLIER 'General case' 0 C--O 1.199 -1.594 0 C-N-CA 130.786 3.634 . . . . 0.0 117.596 -166.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 68.0 tp -74.4 -60.88 2.07 Favored 'General case' 0 C--N 1.268 -2.977 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -55.9 -47.95 76.52 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.846 1.258 . . . . 0.0 109.417 173.12 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.586 ' HB3' ' HA ' ' A' ' 588' ' ' GLU . 0.0 OUTLIER -69.13 -27.8 65.89 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.528 -175.44 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 592' ' ' TYR . . . . . 0.675 ' HB2' ' O ' ' A' ' 588' ' ' GLU . 28.8 t80 -61.52 -44.39 97.15 Favored 'General case' 0 CA--C 1.494 -1.178 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 177.586 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -57.17 -50.19 73.6 Favored 'General case' 0 C--O 1.238 0.461 0 O-C-N 123.888 0.743 . . . . 0.0 110.741 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 32.3 tp -59.38 -48.88 79.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.436 0.636 . . . . 0.0 110.113 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -63.4 -35.57 80.85 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.247 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.68 -41.76 95.83 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 123.747 0.819 . . . . 0.0 109.388 178.27 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 82.9 mt -57.15 -52.15 59.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 CA-C-O 121.661 0.743 . . . . 0.0 109.218 173.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 77.7 t -63.17 -33.25 59.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.39 -178.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.526 ' HA ' ' HD3' ' A' ' 602' ' ' LYS . . . -59.7 -46.44 89.08 Favored 'General case' 0 CA--C 1.502 -0.903 0 CA-C-O 121.239 0.542 . . . . 0.0 110.086 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 600' ' ' LYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 604' ' ' ARG . 62.5 mttp -68.85 -31.89 71.17 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.567 177.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -68.68 -33.59 74.24 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.014 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.526 ' HD3' ' HA ' ' A' ' 599' ' ' ALA . 8.3 mtpm? -65.94 -62.69 1.36 Allowed 'General case' 0 CA--C 1.49 -1.347 0 CA-C-O 123.102 1.429 . . . . 0.0 108.693 175.308 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -76.32 1.35 16.4 Favored 'General case' 0 N--CA 1.408 -2.552 0 CA-C-N 112.205 -2.271 . . . . 0.0 113.614 -169.742 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 604' ' ' ARG . . . . . 0.483 ' HB2' ' O ' ' A' ' 600' ' ' LYS . 15.7 ttm180 -67.58 -30.21 69.77 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 175.027 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 71.6 mtm . . . . . 0 N--CA 1.435 -1.213 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.818 179.749 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -78.8 166.04 22.89 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 170.741 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -125.93 69.48 1.2 Allowed 'General case' 0 CA--C 1.491 -1.304 0 CA-C-O 121.647 0.737 . . . . 0.0 110.28 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 466' ' ' LEU . . . . . 0.406 HD13 HH22 ' A' ' 474' ' ' ARG . 65.6 mt -72.53 124.01 24.33 Favored 'General case' 0 C--N 1.298 -1.661 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.384 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 27.3 p -86.84 160.25 18.81 Favored 'General case' 0 C--N 1.292 -1.902 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.994 -177.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -64.11 -29.17 70.31 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.305 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -66.79 -44.43 81.33 Favored 'General case' 0 C--O 1.19 -2.029 0 O-C-N 123.293 0.37 . . . . 0.0 110.32 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.572 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 1.1 tm-20 -62.65 -28.67 70.08 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-O 121.348 0.594 . . . . 0.0 109.639 -178.038 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.566 ' O ' ' HD3' ' A' ' 471' ' ' LYS . 0.9 OUTLIER -71.2 -35.54 71.6 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 175.033 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -60.52 -48.94 79.56 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 473' ' ' GLU . . . . . 0.566 ' HB3' ' CD2' ' A' ' 504' ' ' PHE . 1.7 mp0 -58.54 -39.93 81.59 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 121.146 0.498 . . . . 0.0 110.722 175.911 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.572 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 93.8 mtt180 -62.23 -35.34 78.61 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.22 176.87 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -66.26 -38.12 87.1 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.651 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 476' ' ' PHE . . . . . 0.485 ' O ' HD12 ' A' ' 480' ' ' LEU . 1.3 m-85 -65.83 -26.73 67.8 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 174.285 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 95.1 mt -82.66 -17.08 45.83 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 175.324 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -40.95 -65.13 0.46 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -168.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.485 ' HA ' ' SD ' ' A' ' 481' ' ' MET . 5.7 t-80 -147.57 36.68 0.89 Allowed 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.131 -1.028 . . . . 0.0 108.869 -174.046 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.495 HD13 HG21 ' A' ' 486' ' ' THR . 84.0 mt -115.89 29.57 7.9 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.222 -174.467 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 481' ' ' MET . . . . . 0.485 ' SD ' ' HA ' ' A' ' 479' ' ' HIS . 2.1 mpp? -76.07 -38.31 57.2 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.759 -176.363 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -67.82 -48.2 66.89 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-O 121.912 0.863 . . . . 0.0 110.126 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . 0.432 9.0 p-10 -74.51 60.49 0.88 Allowed 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 484' ' ' LYS . . . . . 0.489 ' HB2' ' CE2' ' A' ' 515' ' ' TYR . 19.5 ptpt -40.83 -30.97 0.14 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.144 2.178 . . . . 0.0 112.858 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -52.17 -50.19 62.3 Favored 'General case' 0 CA--C 1.504 -0.804 0 C-N-CA 124.796 1.238 . . . . 0.0 108.94 176.292 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.495 HG21 HD13 ' A' ' 480' ' ' LEU . 31.6 m -64.28 -35.88 82.27 Favored 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 125.324 1.45 . . . . 0.0 111.968 -177.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -59.32 -53.13 61.7 Favored 'General case' 0 C--O 1.258 1.506 0 CA-C-O 121.76 0.79 . . . . 0.0 109.151 177.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.515 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 4.0 mm? -72.2 -25.06 61.52 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.908 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -65.26 -33.15 75.3 Favored 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 122.982 0.176 . . . . 0.0 110.604 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.79 -33.95 40.07 Favored 'General case' 0 N--CA 1.385 -3.679 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -66.47 -27.33 67.72 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 120.1 -0.64 . . . . 0.0 112.4 173.145 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 492' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 14.4 mm-40 -78.51 -28.28 46.25 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.083 0.468 . . . . 0.0 110.967 175.573 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 51.0 m -85.09 -49.54 8.18 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.601 0.715 . . . . 0.0 110.986 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.2 t -135.96 100.23 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.526 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.523 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 495' ' ' ASP . . . . . 0.426 ' C ' ' H ' ' A' ' 497' ' ' ASP . 6.0 p-10 -95.19 14.91 20.61 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 122.405 1.097 . . . . 0.0 109.171 174.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -84.64 21.76 1.45 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 127.073 2.149 . . . . 0.0 109.42 178.152 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 497' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 495' ' ' ASP . 9.7 t70 -53.16 -1.44 0.02 OUTLIER 'General case' 0 CA--C 1.563 1.46 0 C-N-CA 128.991 2.916 . . . . 0.0 114.709 -176.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -73.88 -0.99 17.69 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 120.686 -1.259 . . . . 0.0 112.033 -175.463 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -83.46 -18.84 37.2 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.897 177.446 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 500' ' ' THR . . . . . 0.459 ' HB ' ' HB3' ' A' ' 504' ' ' PHE . 23.4 p -60.87 158.23 13.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -172.152 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -91.8 167.31 12.25 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.533 175.202 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -59.84 -24.32 64.11 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 118.453 0.57 . . . . 0.0 110.054 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -54.79 -53.65 52.41 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 175.873 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 504' ' ' PHE . . . . . 0.566 ' CD2' ' HB3' ' A' ' 473' ' ' GLU . 10.6 t80 -64.4 -40.02 94.98 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.415 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -57.67 -47.2 82.97 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 123.943 0.777 . . . . 0.0 109.25 -176.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.616 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -60.77 -45.53 93.99 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.135 -179.176 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 45.9 t -62.8 -48.55 87.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 120.385 -0.526 . . . . 0.0 110.221 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -49.54 -49.78 44.68 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.951 0.782 . . . . 0.0 110.654 174.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -58.22 -55.84 29.74 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.946 -177.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 506' ' ' TYR . 12.1 t -57.69 -52.03 62.64 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.512 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 88.9 mt -56.31 -53.05 61.88 Favored 'General case' 0 C--O 1.213 -0.859 0 O-C-N 123.819 0.699 . . . . 0.0 111.421 -176.434 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -61.64 -38.49 87.87 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.519 0.728 . . . . 0.0 110.588 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -67.49 -52.27 41.22 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.451 -176.515 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . 0.264 5.0 p90 -73.71 -31.11 63.24 Favored 'General case' 0 C--O 1.192 -1.936 0 C-N-CA 119.008 -1.077 . . . . 0.0 111.985 -178.981 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 515' ' ' TYR . . . . . 0.512 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 0.4 OUTLIER -55.67 -41.54 73.8 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.811 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -67.18 -18.69 65.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.151 -0.932 . . . . 0.0 112.497 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -115.67 -44.8 2.93 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 119.948 -0.701 . . . . 0.0 112.168 -178.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 518' ' ' ASN . . . . . 0.427 ' HB3' ' H ' ' A' ' 519' ' ' ASP . 15.0 m120 -125.59 -151.79 0.49 Allowed 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 124.852 1.261 . . . . 0.0 111.391 -168.741 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 519' ' ' ASP . . . . . 0.427 ' H ' ' HB3' ' A' ' 518' ' ' ASN . 6.1 p-10 -105.51 -157.49 0.62 Allowed 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 127.047 2.139 . . . . 0.0 110.456 -173.738 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -60.51 177.68 0.27 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 125.834 1.654 . . . . 0.0 113.876 -170.914 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -90.29 146.92 23.84 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.87 1.668 . . . . 0.0 109.085 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -118.58 155.33 31.12 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 50.1 pt -64.0 -21.87 29.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 O-C-N 122.249 -0.282 . . . . 0.0 111.567 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 22.7 t -57.66 -34.87 69.82 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -63.71 -50.32 69.65 Favored 'General case' 0 C--N 1.349 0.549 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -59.0 -44.37 91.66 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.594 0.712 . . . . 0.0 110.857 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.502 ' O ' HG22 ' A' ' 530' ' ' VAL . 55.8 t -65.1 -37.46 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.531 0 C-N-CA 124.052 0.941 . . . . 0.0 111.912 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -70.21 -16.85 63.11 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 117.95 -1.5 . . . . 0.0 110.213 175.644 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -80.59 6.42 12.65 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 172.89 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.502 HG22 ' O ' ' A' ' 527' ' ' VAL . 26.9 m -74.34 10.63 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.514 173.559 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -99.12 -15.02 19.13 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.943 177.24 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 532' ' ' SER . . . . . 0.478 ' HB2' ' HB2' ' A' ' 535' ' ' LEU . 27.1 m -88.69 156.2 19.14 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.776 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -63.18 -75.01 0.08 Allowed 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -86.4 -28.55 23.51 Favored 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 121.399 0.619 . . . . 0.0 110.257 -173.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.478 ' HB2' ' HB2' ' A' ' 532' ' ' SER . 58.3 mt -62.08 -32.95 73.55 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.942 -174.56 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -53.84 -63.43 1.15 Allowed 'General case' 0 C--O 1.255 1.37 0 O-C-N 124.293 0.996 . . . . 0.0 109.675 176.224 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -63.26 -55.72 22.52 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.359 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.421 ' O ' HD13 ' A' ' 542' ' ' LEU . 23.4 m -58.83 -53.81 54.21 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -174.752 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 539' ' ' LEU . . . . . 0.422 HD13 ' HA ' ' A' ' 539' ' ' LEU 0.299 4.0 mm? -63.88 -40.4 96.45 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -176.493 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 58.6 mt -68.85 -34.91 66.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 118.637 -1.225 . . . . 0.0 109.774 176.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 34.6 t -56.76 -48.91 76.76 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.5 ' HA ' ' CE2' ' A' ' 545' ' ' TYR . 6.6 mp -64.7 -32.22 73.8 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 124.671 1.188 . . . . 0.0 112.454 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.59 -54.83 7.26 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.363 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 544' ' ' GLN . . . . . 0.551 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 46.9 tt0 -74.64 35.08 0.1 Allowed 'General case' 0 CA--C 1.564 1.489 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -173.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 545' ' ' TYR . . . . . 0.5 ' CE2' ' HA ' ' A' ' 542' ' ' LEU . 16.6 m-85 -77.28 166.35 23.29 Favored 'General case' 0 C--N 1.265 -3.105 0 O-C-N 120.491 -1.38 . . . . 0.0 110.882 170.498 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -93.5 117.85 30.59 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 92.8 mt -74.43 -16.27 60.88 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.199 -176.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -70.5 -43.07 70.44 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.838 177.391 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 549' ' ' ASP . . . . . 0.467 ' C ' ' HD3' ' A' ' 551' ' ' PRO . 40.6 m-20 -74.81 1.21 13.1 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.424 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.406 ' N ' ' HD3' ' A' ' 551' ' ' PRO . 35.6 tt0 -119.59 67.99 10.83 Favored Pre-proline 0 CA--C 1.567 1.623 0 C-N-CA 119.262 -0.975 . . . . 0.0 113.039 -175.071 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 551' ' ' PRO . . . . . 0.524 ' HD2' ' H ' ' A' ' 552' ' ' TYR . 72.1 Cg_endo -119.25 -14.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.579 2.747 0 C-N-CA 122.24 1.96 . . . . 0.0 114.658 168.44 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 552' ' ' TYR . . . . . 0.524 ' H ' ' HD2' ' A' ' 551' ' ' PRO . 48.7 m-85 -114.15 52.8 0.81 Allowed 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 124.773 1.229 . . . . 0.0 108.287 -171.206 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . 0.277 7.5 mm-40 -58.84 67.84 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 118.622 2.823 . . . . 0.0 118.622 -170.049 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 554' ' ' ASN . . . . . 0.4 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 9.6 m120 -65.94 -20.95 66.38 Favored 'General case' 0 C--O 1.194 -1.816 0 CA-C-N 113.649 -1.614 . . . . 0.0 108.992 169.22 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -43.91 -41.01 4.95 Favored 'General case' 0 C--O 1.204 -1.294 0 C-N-CA 124.611 1.164 . . . . 0.0 111.519 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 62.1 mt -64.17 -45.32 96.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 557' ' ' ASP . . . . . 0.4 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 13.7 t70 -60.03 -45.49 92.62 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.256 175.677 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 558' ' ' ASP . . . . . 0.504 ' O ' HG23 ' A' ' 562' ' ' VAL . 18.4 t70 -58.16 -56.34 23.34 Favored 'General case' 0 CA--C 1.503 -0.828 0 C-N-CA 124.404 1.082 . . . . 0.0 109.407 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -48.03 -53.16 17.21 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 125.28 1.432 . . . . 0.0 110.138 176.169 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 37.2 t -57.69 -50.94 75.84 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.949 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.772 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.04 -31.41 71.82 Favored 'General case' 0 C--O 1.209 -1.034 0 C-N-CA 123.3 0.64 . . . . 0.0 111.677 -179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 562' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 558' ' ' ASP . 78.0 t -69.0 -34.71 65.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 CA-C-O 121.329 0.585 . . . . 0.0 111.776 178.088 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 563' ' ' ILE . . . . . . . . . . . . . 57.3 mt -87.41 -35.67 8.72 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.248 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 564' ' ' ASN . . . . . 0.493 ' HA ' ' OE1' ' A' ' 572' ' ' GLU . 4.1 t-20 -77.62 2.57 16.22 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 113.694 -1.594 . . . . 0.0 109.83 176.52 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.32 -31.09 67.01 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 174.838 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -76.81 5.77 7.21 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -174.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . 162.51 145.39 4.32 Favored Glycine 1 N--CA 1.393 -4.226 0 C-N-CA 119.422 -1.37 . . . . 0.0 111.487 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -138.59 47.53 1.96 Allowed 'General case' 0 C--N 1.262 -3.205 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 170.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 569' ' ' GLU . . . . . 0.524 ' CD ' ' H ' ' A' ' 570' ' ' THR . 0.0 OUTLIER -99.4 -98.28 0.23 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -175.037 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 570' ' ' THR . . . . . 0.524 ' H ' ' CD ' ' A' ' 569' ' ' GLU . 15.4 m -108.3 -55.32 2.39 Favored 'General case' 0 N--CA 1.421 -1.906 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 23.2 mt -62.26 -49.64 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.706 0 CA-C-O 121.977 0.894 . . . . 0.0 109.385 -173.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 572' ' ' GLU . . . . . 0.56 ' O ' ' HB3' ' A' ' 575' ' ' ASN . 60.2 mm-40 -67.3 -19.15 65.43 Favored 'General case' 0 N--CA 1.404 -2.774 0 CA-C-N 113.862 -1.517 . . . . 0.0 112.723 -176.225 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 48.8 m -71.28 -38.69 71.81 Favored 'General case' 0 C--O 1.269 2.087 0 O-C-N 121.925 -0.484 . . . . 0.0 110.049 173.721 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.745 ' HA ' ' HE2' ' A' ' 602' ' ' LYS . 7.2 mp -62.11 -38.84 90.44 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 123.267 1.508 . . . . 0.0 109.419 177.071 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 575' ' ' ASN . . . . . 0.625 ' O ' ' HB3' ' A' ' 578' ' ' LEU 0.263 10.2 t30 -60.54 -27.57 67.76 Favored 'General case' 1 C--N 1.235 -4.403 0 CA-C-N 111.781 -2.463 . . . . 0.0 112.016 175.124 . . . . . . . . 4 3 . 1 . 013 nuclear build full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -69.81 -34.5 73.79 Favored 'General case' 0 C--N 1.314 -0.952 0 O-C-N 120.788 -1.195 . . . . 0.0 111.266 171.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 577' ' ' LYS . . . . . 0.499 ' HB3' ' O ' ' A' ' 574' ' ' LEU . 50.0 tptt -60.03 -39.21 85.11 Favored 'General case' 0 CA--C 1.561 1.375 0 CA-C-O 121.9 0.857 . . . . 0.0 109.502 170.439 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.625 ' HB3' ' O ' ' A' ' 575' ' ' ASN . 63.6 tp -55.12 -37.48 66.96 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.591 171.423 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.454 ' HG2' HD23 ' A' ' 594' ' ' LEU . 8.5 tpt180 -62.68 -32.4 73.47 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-O 121.75 0.786 . . . . 0.0 110.245 175.533 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 580' ' ' GLU . . . . . 0.455 ' HG3' ' NE2' ' A' ' 595' ' ' GLN . 26.2 tt0 -62.72 -35.63 80.37 Favored 'General case' 0 C--O 1.2 -1.527 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 175.535 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -66.97 -25.97 66.58 Favored 'General case' 0 CA--C 1.569 1.69 0 CA-C-O 121.468 0.651 . . . . 0.0 111.752 171.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.461 ' O ' ' N ' ' A' ' 584' ' ' ILE . 14.6 m -66.7 -23.27 66.1 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 126.311 1.845 . . . . 0.0 111.888 176.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.413 HH21 ' HG2' ' A' ' 580' ' ' GLU . 14.6 ptp180 -33.33 13.56 0.0 OUTLIER 'General case' 0 N--CA 1.536 3.826 0 N-CA-C 118.13 2.641 . . . . 0.0 118.13 173.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.461 ' N ' ' O ' ' A' ' 582' ' ' THR . 33.4 pt -81.78 12.28 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.408 0 C-N-CA 124.675 1.19 . . . . 0.0 110.152 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 132.73 57.77 0.08 OUTLIER Glycine 0 CA--C 1.5 -0.892 0 C-N-CA 119.255 -1.45 . . . . 0.0 115.613 171.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 586' ' ' ASP . . . . . 0.465 ' O ' ' HG3' ' A' ' 591' ' ' LYS . 22.0 p-10 -142.22 58.99 1.47 Allowed 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 104.445 -2.428 . . . . 0.0 104.445 173.27 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.491 ' HA ' ' HE2' ' A' ' 591' ' ' LYS 0.376 8.1 p -64.75 -87.89 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.874 0 N-CA-C 121.117 3.747 . . . . 0.0 121.117 -162.971 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.575 ' CD ' ' H ' ' A' ' 589' ' ' LEU 0.374 0.0 OUTLIER -65.83 -88.22 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 117.594 2.442 . . . . 0.0 117.594 -158.478 . . . . . . . . 4 4 . 1 . 013 nuclear build full ' A' A ' 589' ' ' LEU . . . . . 0.575 ' H ' ' CD ' ' A' ' 588' ' ' GLU . 7.2 tt -71.8 -33.23 68.37 Favored 'General case' 0 C--N 1.282 -2.367 0 C-N-CA 124.482 1.113 . . . . 0.0 108.388 -175.261 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -54.75 -54.09 46.58 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 113.585 -1.643 . . . . 0.0 110.99 -177.302 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.51 ' O ' ' HB3' ' A' ' 595' ' ' GLN . 50.6 mtmt -84.99 -38.24 19.48 Favored 'General case' 0 C--O 1.199 -1.56 0 CA-C-O 118.619 -0.705 . . . . 0.0 112.631 179.255 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -50.1 -54.74 18.45 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.366 0.416 . . . . 0.0 110.902 -174.063 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 593' ' ' TYR . . . . . 0.599 ' HA ' HD13 ' A' ' 597' ' ' ILE . 55.7 m-85 -64.99 -60.5 2.97 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 177.21 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.454 HD23 ' HG2' ' A' ' 579' ' ' ARG . 2.8 tp -59.65 -53.15 61.33 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 122.63 1.205 . . . . 0.0 110.624 -170.416 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.51 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 18.9 tt0 -71.93 -64.37 0.95 Allowed 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 113.684 -1.598 . . . . 0.0 112.414 -174.599 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -60.8 -39.66 89.76 Favored 'General case' 0 C--O 1.246 0.92 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.401 -167.807 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.599 HD13 ' HA ' ' A' ' 593' ' ' TYR . 1.7 mp -61.39 -56.54 17.16 Favored 'Isoleucine or valine' 0 C--O 1.252 1.198 0 O-C-N 123.671 0.607 . . . . 0.0 110.843 176.272 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 23.6 t -78.53 -30.45 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 C-N-CA 118.842 -1.143 . . . . 0.0 113.095 -172.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 602' ' ' LYS . . . -63.23 -40.85 98.62 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 122.637 0.375 . . . . 0.0 110.766 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 600' ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' A' ' 597' ' ' ILE . 64.7 pttt -66.69 -40.77 88.66 Favored 'General case' 0 N--CA 1.439 -1.017 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.29 176.314 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 601' ' ' ASN . . . . . 0.565 ' O ' ' HG2' ' A' ' 605' ' ' MET . 66.8 t30 -66.81 -30.68 70.93 Favored 'General case' 0 C--O 1.213 -0.819 0 CA-C-O 120.81 0.338 . . . . 0.0 110.848 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.745 ' HE2' ' HA ' ' A' ' 574' ' ' LEU . 31.7 tttm -60.19 -51.96 67.37 Favored 'General case' 0 CA--C 1.5 -0.976 0 C-N-CA 124.134 0.974 . . . . 0.0 108.909 178.166 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -68.96 -39.17 79.64 Favored 'General case' 0 N--CA 1.417 -2.078 0 CA-C-N 113.913 -1.494 . . . . 0.0 109.712 -177.452 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -78.31 14.04 1.34 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 605' ' ' MET . . . . . 0.565 ' HG2' ' O ' ' A' ' 601' ' ' ASN . 85.0 mmm . . . . . 0 CA--C 1.502 -0.883 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 N--CA 1.441 -0.879 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -80.44 119.15 22.75 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -90.38 50.33 1.82 Allowed 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.503 1.144 . . . . 0.0 109.099 -173.705 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.47 125.04 22.18 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-N 114.0 -1.455 . . . . 0.0 110.616 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 15.0 m -95.16 150.34 20.31 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.891 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 468' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' A' ' 471' ' ' LYS . 19.9 tpp180 -60.98 -20.38 62.32 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.621 1.169 . . . . 0.0 110.712 -178.771 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.778 HE21 ' HE2' ' A' ' 566' ' ' LYS . 0.9 OUTLIER -58.99 -40.57 85.25 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.642 177.971 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 34.2 tt0 -67.03 -30.81 71.0 Favored 'General case' 0 C--O 1.203 -1.345 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 468' ' ' ARG . 27.1 tptp -62.48 -37.93 87.88 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.904 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -64.44 -45.43 87.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.559 0.695 . . . . 0.0 109.239 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.94 -33.46 74.31 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.745 177.542 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.582 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 98.9 mtt180 -65.92 -36.8 84.37 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 122.459 0.304 . . . . 0.0 110.524 175.118 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -65.9 -45.5 81.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.307 0.575 . . . . 0.0 109.954 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.28 -27.78 68.71 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 122.031 0.919 . . . . 0.0 111.173 175.821 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.48 ' HB3' ' O ' ' A' ' 474' ' ' ARG . 61.8 tp -77.22 -14.83 59.7 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 126.004 1.722 . . . . 0.0 113.557 -175.314 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -41.12 -50.26 3.46 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.312 1.045 . . . . 0.0 110.833 -173.204 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -168.2 128.23 1.28 Allowed 'General case' 0 CA--C 1.48 -1.73 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 166.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.515 ' HG ' ' OD2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -58.48 119.49 7.09 Favored 'General case' 0 C--O 1.251 1.145 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 -179.599 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 72.8 mtm -93.21 -53.57 4.05 Favored 'General case' 0 N--CA 1.424 -1.759 0 N-CA-C 115.343 1.608 . . . . 0.0 115.343 -172.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 482' ' ' ARG . . . . . 0.641 ' HB2' ' OG1' ' A' ' 486' ' ' THR 0.255 36.4 mmt180 -76.33 -99.05 0.02 OUTLIER 'General case' 0 C--O 1.212 -0.875 0 C-N-CA 116.379 -2.129 . . . . 0.0 114.409 -174.263 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 483' ' ' ASP . . . . . 0.644 ' OD2' ' HG3' ' A' ' 484' ' ' LYS . 25.4 t70 -145.72 -86.89 0.11 Allowed 'General case' 0 C--O 1.196 -1.726 0 C-N-CA 115.639 -2.424 . . . . 0.0 116.819 170.157 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 484' ' ' LYS . . . . . 0.644 ' HG3' ' OD2' ' A' ' 483' ' ' ASP . 61.8 mttp -97.54 -52.33 3.82 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.669 -1.15 . . . . 0.0 113.464 -178.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -56.45 -42.75 78.69 Favored 'General case' 0 CA--C 1.497 -1.085 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.88 -178.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.641 ' OG1' ' HB2' ' A' ' 482' ' ' ARG . 42.2 m -61.51 -37.57 84.2 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.975 -177.705 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -62.62 -54.12 44.32 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.658 177.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 77.5 mt -66.8 -28.46 68.4 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -61.49 -40.97 96.5 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 123.765 0.826 . . . . 0.0 110.659 -179.18 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -92.51 -37.15 12.67 Favored 'General case' 0 N--CA 1.399 -3.02 0 C-N-CA 120.486 -0.485 . . . . 0.0 110.732 178.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -79.95 -59.65 2.64 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -175.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -78.82 -7.4 57.83 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.839 0.828 . . . . 0.0 111.751 -166.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 18.2 m -75.51 -6.8 52.04 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.469 177.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 46.0 t -100.27 99.22 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -97.45 -82.84 0.41 Allowed 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -83.17 -26.88 30.49 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.575 0.702 . . . . 0.0 110.876 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 497' ' ' ASP . . . . . 0.408 ' C ' ' H ' ' A' ' 499' ' ' PHE . 38.0 t70 -77.56 31.09 0.15 Allowed 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 125.574 1.55 . . . . 0.0 110.914 -178.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -72.93 33.53 0.07 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.688 1.195 . . . . 0.0 111.78 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 499' ' ' PHE . . . . . 0.408 ' H ' ' C ' ' A' ' 497' ' ' ASP . 15.1 p90 -73.52 -13.81 61.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.055 -179.719 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.84 150.78 31.78 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -74.72 163.81 27.28 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 114.801 -1.091 . . . . 0.0 112.052 -172.158 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 502' ' ' GLN . . . . . 0.47 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 59.9 tt0 -56.18 -5.22 0.17 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.438 1.895 . . . . 0.0 111.839 177.723 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -52.6 -45.17 66.43 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 172.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.84 -30.31 70.03 Favored 'General case' 0 C--O 1.204 -1.301 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.646 175.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 505' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 22.1 tptm -70.35 -47.75 59.54 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.241 0.617 . . . . 0.0 110.332 -175.415 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.517 ' O ' HG23 ' A' ' 510' ' ' VAL . 96.9 m-85 -59.63 -46.8 87.92 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 507' ' ' VAL . . . . . 0.413 ' CG2' HD11 ' A' ' 477' ' ' LEU . 71.1 t -58.25 -57.49 10.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 114.227 -1.351 . . . . 0.0 111.263 178.134 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -48.41 -45.59 36.32 Favored 'General case' 0 C--O 1.212 -0.885 0 O-C-N 124.047 0.842 . . . . 0.0 112.349 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.3 -53.77 52.46 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.048 0.452 . . . . 0.0 110.491 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 506' ' ' TYR . 24.5 t -60.85 -51.35 74.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 CA-C-O 121.368 0.604 . . . . 0.0 111.097 -178.63 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 10.4 mp -66.91 -34.05 76.92 Favored 'General case' 0 C--O 1.2 -1.546 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.482 -175.707 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -65.85 -29.53 70.0 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 120.99 0.424 . . . . 0.0 110.548 176.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.12 -37.05 80.7 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.359 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 514' ' ' PHE . . . . . 0.405 ' HB3' ' HA ' ' A' ' 519' ' ' ASP . 28.9 m-85 -76.46 -46.16 28.1 Favored 'General case' 0 C--O 1.2 -1.551 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.324 178.738 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -46.21 -32.83 3.24 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.901 1.68 . . . . 0.0 111.129 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -57.55 -29.8 64.69 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.783 178.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 11.5 tp10 -119.77 -59.73 1.78 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.016 175.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -158.31 124.32 4.61 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 176.109 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 519' ' ' ASP . . . . . 0.515 ' OD2' ' HG ' ' A' ' 480' ' ' LEU . 24.3 t0 -95.4 96.75 9.32 Favored 'General case' 0 CA--C 1.484 -1.572 0 C-N-CA 117.274 -1.77 . . . . 0.0 110.468 179.616 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 520' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 482' ' ' ARG . 88.5 mt-30 -137.86 77.1 1.61 Allowed 'General case' 0 C--N 1.274 -2.7 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 178.196 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -46.53 121.05 3.21 Favored 'General case' 0 N--CA 1.427 -1.588 0 C-N-CA 126.093 1.757 . . . . 0.0 113.039 -174.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -91.02 167.13 12.61 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.602 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 44.7 pt -87.07 -17.37 8.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 C-N-CA 120.166 -0.614 . . . . 0.0 112.132 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 23.0 t -60.16 -46.17 90.6 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.19 -38.04 87.6 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.676 176.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -60.37 -48.03 83.53 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 120.998 0.428 . . . . 0.0 110.409 176.422 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.518 ' O ' HG22 ' A' ' 530' ' ' VAL . 97.5 t -64.98 -30.71 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 C-N-CA 123.719 0.807 . . . . 0.0 111.018 177.363 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -65.1 -32.55 74.31 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.416 -0.802 . . . . 0.0 109.159 172.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -77.71 10.78 2.47 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 176.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.518 HG22 ' O ' ' A' ' 527' ' ' VAL . 22.1 m -75.26 6.79 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 118.313 -1.355 . . . . 0.0 111.264 171.412 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -93.59 -8.06 42.28 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.079 175.748 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 20.1 m -85.66 154.76 21.45 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 176.009 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -71.71 -73.11 0.19 Allowed 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 178.535 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -81.22 -36.8 29.58 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.837 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 43.9 tp -65.16 -34.6 78.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.865 -177.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 38.2 ttp180 -57.89 -54.53 45.88 Favored 'General case' 0 C--O 1.254 1.315 0 CA-C-O 121.718 0.77 . . . . 0.0 109.344 176.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -53.42 -70.34 0.09 Allowed 'General case' 0 N--CA 1.425 -1.696 0 CA-C-N 113.369 -1.741 . . . . 0.0 110.669 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.441 ' O ' HD13 ' A' ' 542' ' ' LEU 0.291 6.4 p -64.4 -52.69 56.91 Favored 'General case' 0 N--CA 1.425 -1.688 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -173.18 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 51.8 tp -59.03 -44.43 91.74 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -174.685 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 1.8 mp -75.04 -38.87 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 119.551 -0.86 . . . . 0.0 109.43 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 30.1 t -55.41 -45.6 76.71 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.484 175.717 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 545' ' ' TYR . 5.2 mp -64.95 -37.53 87.96 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.063 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 543' ' ' GLU . . . . . 0.478 ' C ' ' H ' ' A' ' 545' ' ' TYR . 13.1 tp10 -64.99 -33.62 76.49 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.884 0.373 . . . . 0.0 110.886 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -76.43 40.9 0.23 Allowed 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 123.048 1.404 . . . . 0.0 110.67 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 545' ' ' TYR . . . . . 0.499 ' HB2' ' O ' ' A' ' 542' ' ' LEU . 2.8 t80 -72.09 -172.69 0.92 Allowed 'General case' 0 C--N 1.283 -2.294 0 C-N-CA 128.658 2.783 . . . . 0.0 110.658 -176.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 546' ' ' ASN . . . . . 0.474 ' HB2' ' OD1' ' A' ' 548' ' ' ASN . 1.6 m-80 -85.98 172.08 10.94 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -80.02 14.19 1.94 Allowed 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.158 0.504 . . . . 0.0 111.689 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 548' ' ' ASN . . . . . 0.474 ' OD1' ' HB2' ' A' ' 546' ' ' ASN . 3.6 p-10 -75.94 -2.03 28.39 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 123.901 0.88 . . . . 0.0 112.472 -176.625 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -69.75 33.34 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.362 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.416 ' HB3' ' CD ' ' A' ' 551' ' ' PRO . 46.2 mt-10 -103.15 -176.99 0.48 Allowed Pre-proline 0 C--N 1.305 -1.336 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 172.645 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 551' ' ' PRO . . . . . 0.416 ' CD ' ' HB3' ' A' ' 550' ' ' GLU . 33.7 Cg_exo -62.97 61.95 0.16 Allowed 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.433 2.089 . . . . 0.0 113.807 176.306 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -135.22 37.73 2.97 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 105.839 -1.911 . . . . 0.0 105.839 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -67.9 67.12 0.1 Allowed 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -171.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -71.3 -21.45 62.07 Favored 'General case' 0 CA--C 1.491 -1.31 0 C-N-CA 125.279 1.432 . . . . 0.0 108.573 172.452 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -45.17 -45.31 11.46 Favored 'General case' 0 C--O 1.207 -1.174 0 C-N-CA 124.63 1.172 . . . . 0.0 109.222 171.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 53.9 mt -67.4 -44.21 87.13 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.447 0 O-C-N 123.649 0.593 . . . . 0.0 109.483 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -59.14 -47.34 85.64 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 120.97 0.415 . . . . 0.0 111.152 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.83 -42.47 81.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.073 0.549 . . . . 0.0 110.286 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 559' ' ' TYR . . . . . 0.579 ' O ' HG12 ' A' ' 563' ' ' ILE . 93.4 t80 -53.6 -51.57 62.6 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.809 1.244 . . . . 0.0 108.763 173.504 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 560' ' ' VAL . . . . . 0.484 HG13 HD13 ' A' ' 578' ' ' LEU . 9.6 t -55.07 -52.19 46.75 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.751 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.483 175.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -55.57 -38.01 68.78 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.34 0.656 . . . . 0.0 111.441 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 62.9 t -73.6 -32.93 37.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 177.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.579 HG12 ' O ' ' A' ' 559' ' ' TYR . 42.0 mm -90.59 -33.87 6.15 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.956 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -174.348 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -86.61 14.64 6.6 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 113.783 -1.553 . . . . 0.0 108.14 176.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -70.85 -19.76 62.61 Favored 'General case' 0 C--N 1.347 0.459 0 N-CA-C 105.494 -2.039 . . . . 0.0 105.494 169.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 566' ' ' LYS . . . . . 0.778 ' HE2' HE21 ' A' ' 469' ' ' GLN . 74.3 mmtt -77.12 -4.85 46.55 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 113.783 -1.553 . . . . 0.0 109.571 173.697 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -84.24 85.88 1.54 Allowed Glycine 0 CA--C 1.47 -2.74 0 CA-C-O 122.466 1.037 . . . . 0.0 113.091 -171.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -99.91 -62.98 1.17 Allowed 'General case' 0 C--N 1.266 -3.034 0 CA-C-N 113.115 -1.542 . . . . 0.0 107.442 173.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -131.77 171.38 13.58 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.68 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.6 m 70.55 -68.13 0.22 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 170.011 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 33.8 pt -70.94 -6.0 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.593 0 CA-C-O 121.512 0.672 . . . . 0.0 111.515 -177.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -69.58 -15.26 63.18 Favored 'General case' 0 N--CA 1.405 -2.72 0 CA-C-O 121.748 0.785 . . . . 0.0 110.69 175.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 22.9 t -69.22 -46.78 66.53 Favored 'General case' 0 N--CA 1.415 -2.223 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 169.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.557 ' O ' ' HG ' ' A' ' 578' ' ' LEU 0.276 3.7 pp -67.6 -22.36 65.37 Favored 'General case' 0 C--O 1.204 -1.332 0 C-N-CA 120.324 -0.55 . . . . 0.0 112.151 178.144 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 43.8 t-20 -55.91 -44.38 78.22 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -59.14 -44.96 92.08 Favored 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.463 174.261 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -62.62 -37.36 86.01 Favored 'General case' 0 C--O 1.205 -1.248 0 CA-C-N 114.728 -1.123 . . . . 0.0 112.015 -178.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 574' ' ' LEU . 91.0 mt -58.13 -39.64 79.24 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 123.196 0.598 . . . . 0.0 110.753 176.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.56 ' HA ' ' HE ' ' A' ' 579' ' ' ARG . 4.8 mmp_? -60.26 -43.83 95.81 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.696 0.76 . . . . 0.0 110.792 175.468 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 580' ' ' GLU . . . . . 0.6 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 40.2 mt-10 -69.05 -34.08 74.62 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.98 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -62.08 -49.31 76.44 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 123.595 0.758 . . . . 0.0 111.932 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.668 ' O ' ' HB2' ' A' ' 586' ' ' ASP . 30.7 p -68.41 -27.72 66.45 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 122.135 0.174 . . . . 0.0 110.865 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.6 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 38.4 ttt180 -49.57 -7.47 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 126.799 2.04 . . . . 0.0 114.051 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 18.1 tt -81.81 31.65 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.593 2.602 0 CA-C-O 122.633 1.206 . . . . 0.0 109.476 175.611 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 129.32 56.43 0.1 Allowed Glycine 0 C--N 1.331 0.305 0 N-CA-C 110.477 -1.049 . . . . 0.0 110.477 178.386 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 586' ' ' ASP . . . . . 0.668 ' HB2' ' O ' ' A' ' 582' ' ' THR . 39.5 t0 -124.26 164.11 20.24 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.353 0.597 . . . . 0.0 112.3 -171.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.431 ' HB ' ' HE3' ' A' ' 591' ' ' LYS . 2.2 t -67.43 22.98 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.578 2.051 0 C-N-CA 129.239 3.016 . . . . 0.0 109.018 171.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.606 ' H ' ' C ' ' A' ' 586' ' ' ASP . 32.9 tt0 -32.43 -40.28 0.05 OUTLIER 'General case' 0 C--O 1.198 -1.632 0 C-N-CA 130.639 3.576 . . . . 0.0 114.075 -168.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.06 -49.37 65.32 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 122.49 0.316 . . . . 0.0 111.05 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -58.61 -45.1 89.87 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 122.278 1.037 . . . . 0.0 109.752 175.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.457 ' HD2' ' OD2' ' A' ' 586' ' ' ASP . 95.7 mttt -77.9 -25.8 48.68 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.669 -1.151 . . . . 0.0 112.581 -175.122 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -61.5 -43.52 98.72 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 173.702 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 593' ' ' TYR . . . . . 0.682 ' O ' HG12 ' A' ' 597' ' ' ILE . 79.2 t80 -60.22 -49.74 76.43 Favored 'General case' 0 C--O 1.203 -1.342 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.266 176.386 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.407 ' O ' ' HB ' ' A' ' 597' ' ' ILE . 26.9 tp -54.31 -46.09 72.75 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 121.909 0.861 . . . . 0.0 110.906 177.268 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -60.96 -50.66 72.49 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.697 -177.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -63.49 -32.58 74.08 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.522 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.682 HG12 ' O ' ' A' ' 593' ' ' TYR . 41.8 mm -55.89 -65.4 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.016 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 598' ' ' VAL . . . . . 0.435 HG22 ' HE2' ' A' ' 602' ' ' LYS . 9.8 p -68.83 -36.73 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.566 -171.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -65.51 -48.95 70.81 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.709 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -68.3 -19.78 64.71 Favored 'General case' 0 C--O 1.21 -1.019 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.941 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -65.48 -43.68 89.46 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 116.313 -0.403 . . . . 0.0 109.994 175.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.435 ' HE2' HG22 ' A' ' 598' ' ' VAL 0.281 46.5 mmtt -67.81 -56.18 10.17 Favored 'General case' 0 CA--C 1.486 -1.512 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 177.166 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -78.39 14.38 1.25 Allowed 'General case' 0 N--CA 1.401 -2.881 0 CA-C-N 110.937 -2.847 . . . . 0.0 112.857 -169.195 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? -61.24 -48.97 79.03 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 171.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 15.0 tpt . . . . . 0 C--N 1.308 -1.213 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.715 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 14.6 p90 . . . . . 0 N--CA 1.435 -1.202 0 CA-C-O 121.755 0.788 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -105.82 127.55 53.17 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 175.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -133.98 57.01 1.82 Allowed 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 175.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.73 144.68 56.84 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.077 -177.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 20.0 m -99.5 133.66 43.5 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.255 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 36.5 ttm105 -60.01 -23.61 63.81 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.489 1.138 . . . . 0.0 109.255 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.583 ' O ' ' HG2' ' A' ' 473' ' ' GLU . 82.4 mt-30 -54.45 -38.14 66.01 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 126.4 1.88 . . . . 0.0 113.308 -177.523 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.498 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 1.8 tm-20 -68.45 -39.16 81.58 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.337 0.589 . . . . 0.0 109.629 -175.661 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -67.73 -33.5 74.99 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.992 175.679 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -70.19 -39.98 74.91 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.703 178.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 473' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 469' ' ' GLN . 6.6 mm-40 -60.88 -39.75 90.39 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.099 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.498 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 95.4 mtt180 -59.49 -47.2 86.43 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.898 176.566 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -65.36 -35.42 80.91 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.054 -178.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.63 -57.63 12.15 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.906 0.754 . . . . 0.0 109.42 179.165 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 27.3 mt -67.74 -31.61 71.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.553 -175.926 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.422 ' HG3' ' HB3' ' A' ' 542' ' ' LEU 0.281 23.3 mmmt -102.54 -5.86 23.49 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 116.917 2.191 . . . . 0.0 116.917 -175.603 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 24.7 m170 -99.4 -22.32 15.59 Favored 'General case' 0 CA--C 1.488 -1.437 0 C-N-CA 119.21 -0.996 . . . . 0.0 110.848 173.204 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 48.6 tp -115.98 102.26 9.5 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 24.0 mmt -67.49 -26.36 66.32 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 122.394 1.093 . . . . 0.0 108.253 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 482' ' ' ARG . . . . . 0.634 ' HA ' ' NE2' ' A' ' 520' ' ' GLN . 3.4 mpt_? -69.14 -7.1 33.04 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 113.707 -1.588 . . . . 0.0 113.858 176.737 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 483' ' ' ASP . . . . . 0.472 ' CG ' ' HB ' ' A' ' 486' ' ' THR . 3.4 t70 -71.4 56.8 0.25 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 122.517 1.151 . . . . 0.0 111.889 -176.751 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 484' ' ' LYS . . . . . 0.513 ' O ' ' HB3' ' A' ' 487' ' ' PHE . 82.3 tttt -93.77 -63.87 1.15 Allowed 'General case' 0 C--O 1.268 2.066 0 CA-C-O 123.066 1.412 . . . . 0.0 107.84 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -60.92 -46.18 91.68 Favored 'General case' 0 CA--C 1.491 -1.307 0 CA-C-N 113.546 -1.661 . . . . 0.0 108.059 175.424 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.472 ' HB ' ' CG ' ' A' ' 483' ' ' ASP . 1.3 m -62.16 -35.7 79.6 Favored 'General case' 0 C--O 1.189 -2.127 0 CA-C-N 114.251 -1.34 . . . . 0.0 110.957 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 487' ' ' PHE . . . . . 0.513 ' HB3' ' O ' ' A' ' 484' ' ' LYS . 7.4 t80 -51.35 -56.37 13.47 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.132 0.492 . . . . 0.0 110.708 174.436 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.58 -27.47 62.21 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 118.541 -1.264 . . . . 0.0 110.667 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -75.18 -32.22 61.19 Favored 'General case' 0 C--O 1.211 -0.964 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 490' ' ' TYR . . . . . 0.425 ' HD1' ' O ' ' A' ' 487' ' ' PHE . 0.0 OUTLIER -73.53 -37.68 65.53 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 -178.502 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 491' ' ' TYR . . . . . 0.507 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 4.0 t80 -65.42 -42.26 92.69 Favored 'General case' 0 N--CA 1.411 -2.424 0 CA-C-N 112.467 -2.151 . . . . 0.0 109.706 -177.212 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -81.6 -32.21 32.16 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.181 -176.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 35.1 m -83.45 -51.29 7.49 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.9 t -128.93 99.06 4.53 Favored 'Isoleucine or valine' 0 C--O 1.244 0.777 0 C-N-CA 118.067 -1.453 . . . . 0.0 113.363 -170.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 35.8 t70 34.26 87.04 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 127.701 2.4 . . . . 0.0 116.929 172.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 5.9 ptmt -90.14 -43.49 10.42 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 177.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.82 -61.53 2.55 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 -161.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -78.94 -10.99 59.98 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 118.769 -1.172 . . . . 0.0 110.723 -174.128 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -86.04 -17.02 36.33 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.778 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 30.3 m -63.02 113.73 3.27 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -174.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -94.49 150.06 20.63 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 171.718 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -57.88 -34.15 69.46 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.276 0.489 . . . . 0.0 111.025 -177.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 503' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 506' ' ' TYR . 82.8 t60 -64.99 -50.37 66.6 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 124.138 0.975 . . . . 0.0 109.726 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -64.65 -31.09 72.16 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.747 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -65.38 -35.61 81.48 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.473 ' CG ' HD11 ' A' ' 535' ' ' LEU . 12.0 m-85 -59.21 -43.47 92.26 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.686 173.442 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 9.7 t -61.73 -46.22 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 120.368 -0.533 . . . . 0.0 109.724 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -49.05 -44.44 41.72 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 123.406 0.441 . . . . 0.0 110.625 175.113 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -60.3 -48.28 82.43 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.035 -179.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.469 HG22 ' CE2' ' A' ' 529' ' ' TYR . 2.9 t -57.19 -43.49 81.82 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.847 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.739 ' HA ' ' HB3' ' A' ' 514' ' ' PHE . 94.7 mt -73.27 -34.27 65.71 Favored 'General case' 0 CA--C 1.565 1.544 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -176.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 30.3 t60 -67.43 -42.92 82.39 Favored 'General case' 0 C--O 1.259 1.566 0 CA-C-O 122.257 1.027 . . . . 0.0 108.541 174.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.65 -25.42 65.71 Favored 'General case' 0 C--O 1.172 -3.019 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.52 174.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 514' ' ' PHE . . . . . 0.882 ' O ' ' HA ' ' A' ' 518' ' ' ASN . 34.0 t80 -71.19 -16.39 62.52 Favored 'General case' 0 C--O 1.18 -2.58 0 C-N-CA 127.096 2.159 . . . . 0.0 111.459 174.97 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -79.85 -44.5 20.39 Favored 'General case' 0 C--N 1.28 -2.429 0 O-C-N 121.406 -0.809 . . . . 0.0 110.747 167.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.84 -53.48 32.09 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 123.119 1.438 . . . . 0.0 108.692 175.299 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 517' ' ' GLU . . . . . 0.452 ' O ' ' HA ' ' A' ' 514' ' ' PHE . 45.2 mt-10 -95.33 63.64 2.58 Favored 'General case' 0 C--N 1.281 -2.404 0 C-N-CA 129.003 2.921 . . . . 0.0 104.842 173.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 518' ' ' ASN . . . . . 0.882 ' HA ' ' O ' ' A' ' 514' ' ' PHE . 12.0 t-20 -59.32 -148.18 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.352 0 C-N-CA 129.886 3.275 . . . . 0.0 114.673 -164.346 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 519' ' ' ASP . . . . . 0.651 ' OD2' ' HG3' ' A' ' 520' ' ' GLN . 0.8 OUTLIER -34.07 -167.96 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.579 0 N-CA-C 120.079 3.363 . . . . 0.0 120.079 -136.817 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 520' ' ' GLN . . . . . 0.651 ' HG3' ' OD2' ' A' ' 519' ' ' ASP 0.313 59.0 mt-30 -59.44 135.68 57.74 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 120.941 3.682 . . . . 0.0 120.941 -146.456 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 521' ' ' TYR . . . . . 0.471 ' N ' ' HE1' ' A' ' 514' ' ' PHE . 5.2 t80 -41.61 133.37 2.67 Favored 'General case' 0 N--CA 1.416 -2.131 0 C-N-CA 131.09 3.756 . . . . 0.0 114.989 -177.181 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 93.5 m-20 -119.25 163.91 16.42 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.336 172.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 5.7 tt -54.17 -32.83 23.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 C-N-CA 124.225 1.01 . . . . 0.0 111.002 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.56 ' HA ' HG12 ' A' ' 527' ' ' VAL . 34.8 p -59.48 -32.79 70.57 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.212 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -69.89 -44.07 70.49 Favored 'General case' 0 C--O 1.254 1.314 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -61.03 -51.4 69.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.869 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.56 HG12 ' HA ' ' A' ' 524' ' ' SER . 9.9 p -69.21 -13.62 17.47 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.0 0 C-N-CA 123.14 0.576 . . . . 0.0 110.747 177.788 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -69.71 -33.85 73.09 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.469 ' CE2' HG22 ' A' ' 510' ' ' VAL 0.256 1.0 OUTLIER -80.63 15.85 1.57 Allowed 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 172.392 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.459 HG23 ' HG3' ' A' ' 536' ' ' ARG . 3.7 p -73.36 5.17 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.042 0 CA-C-O 121.699 0.761 . . . . 0.0 109.83 177.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -95.55 -14.76 23.34 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.702 0.801 . . . . 0.0 110.745 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 8.7 t -106.36 124.49 49.67 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 175.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -58.4 -44.04 88.84 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -170.266 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.25 -39.7 39.43 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -178.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.473 HD11 ' CG ' ' A' ' 506' ' ' TYR . 96.7 mt -67.36 -36.4 81.31 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-O 119.429 -0.32 . . . . 0.0 111.649 177.447 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.459 ' HG3' HG23 ' A' ' 530' ' ' VAL . 67.5 ttt180 -49.26 -67.53 0.26 Allowed 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 124.388 1.055 . . . . 0.0 110.522 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -62.13 -43.82 98.0 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.439 -176.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.46 ' O ' HD13 ' A' ' 542' ' ' LEU . 12.0 m -63.08 -54.62 35.16 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 120.217 -0.593 . . . . 0.0 112.542 -178.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.23 -37.01 85.55 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 38.5 mm -68.14 -38.87 80.38 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 70.1 m -57.03 -41.05 77.89 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.192 0.52 . . . . 0.0 110.741 171.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.484 HD21 ' HB3' ' A' ' 474' ' ' ARG . 7.8 mp -70.65 -24.77 62.77 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 123.198 0.599 . . . . 0.0 112.129 176.343 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -84.86 -35.87 21.93 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.658 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -71.33 29.51 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -176.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -61.93 148.67 42.9 Favored 'General case' 0 C--O 1.257 1.481 0 CA-C-O 121.707 0.765 . . . . 0.0 111.894 -175.187 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -84.04 -176.37 6.24 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.351 -171.143 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.428 ' C ' ' H ' ' A' ' 549' ' ' ASP . 7.4 mp -72.27 17.97 0.1 Allowed 'General case' 0 C--O 1.205 -1.253 0 C-N-CA 124.461 1.105 . . . . 0.0 112.458 -179.132 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 548' ' ' ASN . . . . . 0.406 ' C ' ' H ' ' A' ' 550' ' ' GLU . 17.0 m120 -75.04 20.83 0.13 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.149 0.98 . . . . 0.0 111.774 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 549' ' ' ASP . . . . . 0.428 ' H ' ' C ' ' A' ' 547' ' ' LEU . 25.1 t70 -72.69 33.06 0.07 Allowed 'General case' 0 CA--C 1.569 1.689 0 C-N-CA 125.972 1.709 . . . . 0.0 111.911 -176.51 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.406 ' H ' ' C ' ' A' ' 548' ' ' ASN . 17.0 mm-40 -73.94 170.54 14.09 Favored Pre-proline 0 C--N 1.304 -1.387 0 C-N-CA 124.852 1.261 . . . . 0.0 108.649 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -69.27 73.97 1.1 Allowed 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 121.862 1.708 . . . . 0.0 110.21 171.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -96.24 42.33 1.09 Allowed 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 126.495 1.918 . . . . 0.0 108.356 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 553' ' ' GLU . . . . . 0.585 ' O ' HG12 ' A' ' 556' ' ' ILE . 50.3 mt-10 -71.44 1.02 6.97 Favored 'General case' 0 C--N 1.281 -2.41 0 CA-C-N 114.633 -1.167 . . . . 0.0 112.464 -178.35 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -68.36 -21.47 64.72 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.956 1.702 . . . . 0.0 108.909 171.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -46.01 -49.18 16.39 Favored 'General case' 0 C--N 1.347 0.498 0 C-N-CA 124.065 0.946 . . . . 0.0 110.476 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 556' ' ' ILE . . . . . 0.585 HG12 ' O ' ' A' ' 553' ' ' GLU . 45.4 pt -64.67 -36.46 77.55 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 C-N-CA 123.342 0.657 . . . . 0.0 110.852 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 557' ' ' ASP . . . . . 0.44 ' OD1' HD13 ' A' ' 594' ' ' LEU . 14.3 m-20 -61.31 -50.9 71.09 Favored 'General case' 0 C--O 1.251 1.167 0 C-N-CA 123.533 0.733 . . . . 0.0 110.693 178.146 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 558' ' ' ASP . . . . . 0.441 ' O ' HG23 ' A' ' 562' ' ' VAL . 13.1 t70 -66.99 -42.89 84.3 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.733 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 559' ' ' TYR . . . . . 0.633 ' CZ ' HG13 ' A' ' 563' ' ' ILE . 52.9 t80 -54.19 -53.85 47.88 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.936 178.009 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 32.0 t -55.12 -47.46 77.22 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.383 0 C-N-CA 122.796 0.438 . . . . 0.0 111.537 -177.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.555 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 47.9 t30 -59.02 -47.24 85.94 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 122.342 0.257 . . . . 0.0 110.523 176.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 562' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 558' ' ' ASP . 83.1 t -63.8 -41.76 93.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 121.436 0.636 . . . . 0.0 111.877 -178.543 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.633 HG13 ' CZ ' ' A' ' 559' ' ' TYR . 50.4 mm -83.25 -33.9 10.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.016 0 CA-C-O 121.489 0.662 . . . . 0.0 109.866 -172.694 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -73.95 -12.15 60.56 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.277 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.555 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 34.3 mt-10 -63.43 -15.75 58.57 Favored 'General case' 0 C--N 1.362 1.151 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.737 174.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -57.42 -25.96 60.4 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.339 175.161 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -129.96 -39.89 0.27 Allowed Glycine 0 N--CA 1.442 -0.919 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.899 -179.464 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 70.65 -71.95 0.12 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.756 1.623 . . . . 0.0 110.233 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 73.39 -77.18 0.06 Allowed 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 125.721 1.609 . . . . 0.0 114.009 174.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 570' ' ' THR . . . . . 0.482 ' O ' ' HG ' ' A' ' 574' ' ' LEU . 1.1 m -152.21 160.26 43.41 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 -177.048 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 48.6 mm -56.82 -45.7 83.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 121.961 0.886 . . . . 0.0 109.211 173.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -68.03 -34.55 76.69 Favored 'General case' 0 N--CA 1.422 -1.826 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.649 -173.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 22.8 t -62.95 -38.25 90.3 Favored 'General case' 0 C--O 1.259 1.554 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.341 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 570' ' ' THR . 43.8 mt -60.7 -53.01 62.59 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 175.504 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -52.62 -50.38 63.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.126 -1.397 . . . . 0.0 112.759 -174.944 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 47.6 t60 -59.8 -50.95 71.81 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.462 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -67.55 -32.37 73.09 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -176.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 7.8 mp -60.89 -52.56 64.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.214 0.53 . . . . 0.0 110.462 174.062 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.468 ' HB3' ' HE3' ' A' ' 591' ' ' LYS . 56.6 mtm180 -63.95 -35.06 79.43 Favored 'General case' 0 C--O 1.245 0.848 0 CA-C-O 122.221 1.01 . . . . 0.0 111.151 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 580' ' ' GLU . . . . . 0.492 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 6.0 tp10 -64.87 -33.28 75.63 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.108 178.454 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -63.38 -50.49 69.7 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.783 174.237 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.452 ' HB ' ' HB2' ' A' ' 591' ' ' LYS 0.254 0.7 OUTLIER -59.82 -24.27 64.02 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -178.555 . . . . . . . . 4 4 . 1 . 015 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.492 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 10.9 ttp85 -43.34 -9.02 0.01 OUTLIER 'General case' 0 CA--C 1.605 3.062 0 C-N-CA 124.846 1.259 . . . . 0.0 114.227 169.658 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.7 10.25 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 N-CA-C 115.186 1.55 . . . . 0.0 115.186 -176.248 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 130.01 -54.71 0.78 Allowed Glycine 0 C--N 1.289 -2.03 0 C-N-CA 120.237 -0.982 . . . . 0.0 114.234 174.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 586' ' ' ASP . . . . . 0.475 ' OD2' ' HB3' ' A' ' 589' ' ' LEU . 20.7 t70 -86.33 81.15 8.47 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 118.092 -1.443 . . . . 0.0 109.111 176.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.629 ' O ' ' HB3' ' A' ' 591' ' ' LYS . 96.5 t -73.18 -51.54 25.68 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.331 0 CA-C-N 113.635 -1.62 . . . . 0.0 111.207 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -62.01 -57.16 12.72 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -169.584 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 589' ' ' LEU . . . . . 0.475 ' HB3' ' OD2' ' A' ' 586' ' ' ASP . 50.6 tp -73.21 -64.07 1.05 Allowed 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -175.75 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -51.86 -58.68 5.76 Favored 'General case' 0 CA--C 1.495 -1.158 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.41 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.629 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 83.8 tttt -63.71 -40.08 95.87 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-O 118.072 -0.966 . . . . 0.0 111.007 -173.508 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -53.01 -55.35 24.26 Favored 'General case' 0 C--N 1.362 1.139 0 CA-C-N 118.797 0.726 . . . . 0.0 111.469 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 593' ' ' TYR . . . . . 0.438 ' O ' HG13 ' A' ' 597' ' ' ILE . 63.6 m-85 -61.61 -52.08 65.85 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 120.804 0.335 . . . . 0.0 111.831 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.44 HD13 ' OD1' ' A' ' 557' ' ' ASP . 56.9 mt -62.91 -41.83 99.58 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.193 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.594 ' HG2' ' O ' ' A' ' 591' ' ' LYS . 13.2 pt20 -71.44 -35.27 70.87 Favored 'General case' 0 C--O 1.217 -0.651 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.35 177.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -67.05 -39.12 86.86 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.503 0.186 . . . . 0.0 111.503 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 593' ' ' TYR . 70.9 mt -55.51 -55.83 15.11 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.272 175.703 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 9.5 p -67.91 -32.14 55.07 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.759 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.495 ' O ' ' HG3' ' A' ' 602' ' ' LYS . . . -62.87 -44.53 95.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.148 0.499 . . . . 0.0 110.699 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -70.45 -34.52 72.54 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.956 178.012 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -66.69 -42.3 86.71 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.77 0.319 . . . . 0.0 111.231 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 599' ' ' ALA . 0.0 OUTLIER -69.57 -30.35 68.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 0.0 110.198 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -72.52 -32.59 66.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.907 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -74.38 -4.9 39.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.069 -176.793 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 95.7 mmm . . . . . 0 C--O 1.255 1.349 0 CA-C-O 118.446 -0.788 . . . . 0.0 109.385 -177.883 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 . . . . . 0 N--CA 1.439 -1.022 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -110.19 92.31 4.0 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 175.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -135.09 80.39 1.84 Allowed 'General case' 0 C--N 1.288 -2.106 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 -179.228 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 6.7 mp -69.45 99.44 1.24 Allowed 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 178.072 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 48.4 m -75.32 106.0 6.63 Favored 'General case' 0 N--CA 1.42 -1.938 0 CA-C-O 121.554 0.692 . . . . 0.0 111.087 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -69.82 -16.16 63.23 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.404 175.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.454 HE21 HG23 ' A' ' 563' ' ' ILE . 52.6 mt-30 -59.66 -48.31 82.19 Favored 'General case' 0 C--O 1.189 -2.087 0 O-C-N 123.415 0.447 . . . . 0.0 110.075 173.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -60.0 -30.66 69.29 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-O 122.181 0.991 . . . . 0.0 109.887 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 28.3 mmtm -72.85 -32.13 65.24 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.374 174.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.49 -44.51 64.57 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.963 -178.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 473' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 477' ' ' LEU . 3.0 mp0 -55.6 -44.97 77.5 Favored 'General case' 0 C--N 1.349 0.581 0 O-C-N 123.349 0.406 . . . . 0.0 110.026 173.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -44.83 95.48 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -64.01 -51.19 65.38 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.752 0.31 . . . . 0.0 111.053 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -18.97 64.58 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-O 121.337 0.589 . . . . 0.0 111.758 -179.571 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.481 ' O ' HD13 ' A' ' 477' ' ' LEU . 3.0 tm? -77.25 -26.91 53.02 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 123.868 0.867 . . . . 0.0 110.423 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 33.8 tttm -53.65 -70.67 0.09 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.234 0.614 . . . . 0.0 111.012 -172.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.552 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 32.5 m80 61.54 -170.53 0.16 Allowed 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.962 0.905 . . . . 0.0 112.347 176.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 91.5 mt -115.11 175.54 5.46 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 167.332 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 481' ' ' MET . . . . . 0.42 ' HG3' ' O ' ' A' ' 521' ' ' TYR . 1.6 mpt? -73.6 -17.81 61.13 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 121.472 0.653 . . . . 0.0 110.282 -178.921 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -65.12 -35.03 79.84 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.802 175.631 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 483' ' ' ASP . . . . . 0.552 ' HB2' ' HB3' ' A' ' 479' ' ' HIS . 26.9 m-20 -70.85 52.79 0.15 Allowed 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 116.371 1.989 . . . . 0.0 116.371 -169.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -70.7 -42.45 70.63 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.118 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.83 -51.78 66.84 Favored 'General case' 0 CA--C 1.501 -0.938 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.797 177.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.514 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 6.0 m -59.73 -32.93 71.01 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.245 -177.768 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -59.94 -54.82 41.61 Favored 'General case' 0 C--N 1.347 0.464 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 173.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.98 -29.85 67.05 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.872 -178.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -65.02 -41.72 95.03 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 121.259 0.552 . . . . 0.0 109.794 -178.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -83.97 -37.91 21.66 Favored 'General case' 0 N--CA 1.411 -2.421 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.123 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -63.36 -40.08 96.29 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -73.63 -20.3 60.62 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.516 0.674 . . . . 0.0 110.305 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 39.4 m -79.02 -11.65 60.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.109 177.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 494' ' ' VAL . . . . . 0.503 HG13 ' HB2' ' A' ' 497' ' ' ASP . 55.1 t -94.97 129.85 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.234 0 CA-C-N 115.309 -0.859 . . . . 0.0 108.842 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -156.09 -60.37 0.1 Allowed 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.703 175.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -82.06 -19.68 39.79 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 122.103 0.954 . . . . 0.0 109.561 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 497' ' ' ASP . . . . . 0.503 ' HB2' HG13 ' A' ' 494' ' ' VAL . 0.6 OUTLIER -69.31 -0.9 6.89 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 126.203 1.801 . . . . 0.0 111.172 -177.523 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -75.59 19.6 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.295 0.638 . . . . 0.0 111.822 -179.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.1 p90 -79.02 -16.99 56.11 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 173.737 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.6 t -58.96 168.41 1.3 Allowed 'General case' 0 CA--C 1.559 1.29 0 C-N-CA 124.843 1.257 . . . . 0.0 111.997 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -66.24 167.31 10.47 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -175.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -63.59 -12.84 36.31 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.572 1.549 . . . . 0.0 109.55 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -56.23 -44.34 79.51 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 124.721 1.208 . . . . 0.0 109.243 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -60.49 -34.87 74.69 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.954 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -70.12 -43.88 70.06 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -176.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.5 ' O ' HG23 ' A' ' 510' ' ' VAL . 73.9 m-85 -59.89 -46.16 90.21 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.448 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 507' ' ' VAL . . . . . 0.462 HG21 ' HG ' ' A' ' 477' ' ' LEU . 27.1 m -71.07 -47.17 63.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-O 118.916 -0.564 . . . . 0.0 112.282 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -51.53 -48.87 62.86 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 123.585 0.553 . . . . 0.0 111.835 176.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.91 -52.07 65.41 Favored 'General case' 0 C--O 1.242 0.694 0 O-C-N 124.029 0.83 . . . . 0.0 110.346 -178.433 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 506' ' ' TYR . 79.0 t -60.18 -50.85 78.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.311 178.067 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 92.5 mt -58.53 -55.77 30.78 Favored 'General case' 0 C--O 1.198 -1.625 0 O-C-N 124.078 0.861 . . . . 0.0 111.741 -176.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -59.95 -39.06 84.28 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.57 0.544 . . . . 0.0 111.694 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -66.04 -51.43 58.29 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.645 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -71.3 -39.29 71.55 Favored 'General case' 0 C--O 1.176 -2.804 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.871 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -53.19 -39.39 63.61 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 122.773 0.429 . . . . 0.0 110.419 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.15 -37.54 78.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -123.01 -2.31 8.7 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -171.11 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 11.6 t-20 -150.2 -151.36 0.39 Allowed 'General case' 0 C--N 1.274 -2.698 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 -172.102 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.43 -163.71 1.08 Allowed 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 124.708 1.203 . . . . 0.0 111.868 -173.102 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.64 160.52 14.22 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 521' ' ' TYR . . . . . 0.42 ' O ' ' HG3' ' A' ' 481' ' ' MET . 4.0 t80 -41.74 132.2 3.01 Favored 'General case' 0 N--CA 1.415 -2.193 0 C-N-CA 126.816 2.046 . . . . 0.0 115.453 -179.195 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -116.83 159.15 22.79 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 171.015 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.4 pp -77.17 -18.91 14.37 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 CA-C-O 121.805 0.812 . . . . 0.0 108.819 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.504 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 8.0 m -57.14 -36.63 70.94 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.095 172.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -64.21 -38.34 90.69 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.343 0.592 . . . . 0.0 109.7 -179.179 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.49 ' O ' HG13 ' A' ' 530' ' ' VAL . . . -60.95 -46.9 88.86 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.814 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 530' ' ' VAL . 82.7 t -61.95 -36.55 74.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 124.715 1.206 . . . . 0.0 111.444 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 528' ' ' GLN . . . . . 0.504 ' HG3' ' O ' ' A' ' 524' ' ' SER . 77.9 mt-30 -62.86 -36.08 82.08 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.651 0.739 . . . . 0.0 110.067 178.03 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.541 ' CG ' ' HD3' ' A' ' 536' ' ' ARG . 0.3 OUTLIER -76.15 -15.01 60.15 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.68 -176.755 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 527' ' ' VAL . 17.3 m -86.19 18.29 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 N-CA-C 116.037 1.865 . . . . 0.0 116.037 -170.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -96.99 -27.23 14.71 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 105.588 -2.005 . . . . 0.0 105.588 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 532' ' ' SER . . . . . 0.401 ' C ' ' H ' ' A' ' 534' ' ' GLU . 14.9 m -92.8 -142.33 0.21 Allowed 'General case' 0 C--N 1.292 -1.923 0 C-N-CA 128.871 2.868 . . . . 0.0 107.007 174.038 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 533' ' ' ASN . . . . . 0.429 ' O ' ' N ' ' A' ' 535' ' ' LEU . 13.4 m120 -29.08 28.08 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.851 1 C-N-CA 136.365 5.866 . . . . 0.0 117.559 173.161 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 534' ' ' GLU . . . . . 0.712 ' O ' ' HG3' ' A' ' 537' ' ' GLU . 10.4 pt-20 -33.28 2.27 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.633 0 C-N-CA 131.32 3.848 . . . . 0.0 116.348 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.455 ' O ' ' HB ' ' A' ' 538' ' ' THR . 3.1 pp -64.93 -17.19 64.14 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 162.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.541 ' HD3' ' CG ' ' A' ' 529' ' ' TYR . 21.0 ttt180 -80.52 -11.99 59.59 Favored 'General case' 0 N--CA 1.402 -2.855 0 CA-C-N 113.149 -1.841 . . . . 0.0 111.288 174.274 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 537' ' ' GLU . . . . . 0.712 ' HG3' ' O ' ' A' ' 534' ' ' GLU . 0.1 OUTLIER -79.15 -32.35 44.3 Favored 'General case' 0 CA--C 1.475 -1.909 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 171.921 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.455 ' HB ' ' O ' ' A' ' 535' ' ' LEU . 62.4 m -59.54 -43.22 93.54 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 114.663 -1.153 . . . . 0.0 109.189 170.328 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 11.2 tp -56.75 -40.51 75.92 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.136 175.224 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 540' ' ' ILE . . . . . 0.479 HD11 ' HA ' ' A' ' 527' ' ' VAL . 80.6 mt -61.17 -49.24 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 C-N-CA 122.81 0.444 . . . . 0.0 110.391 176.071 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.4 m -54.26 -43.23 70.8 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.854 0.835 . . . . 0.0 110.668 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 34.5 tp -72.75 -25.4 61.18 Favored 'General case' 0 CA--C 1.565 1.556 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.208 177.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -79.73 -28.09 40.54 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.717 1.207 . . . . 0.0 109.656 -178.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -68.45 -27.49 66.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.739 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -65.76 115.01 5.45 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.177 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 546' ' ' ASN . . . . . 0.438 ' ND2' ' HB2' ' A' ' 549' ' ' ASP . 58.1 t30 -109.06 82.56 1.61 Allowed 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.317 -174.757 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -84.48 -15.4 46.14 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.735 176.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -78.71 -3.1 42.53 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.443 -178.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 549' ' ' ASP . . . . . 0.438 ' HB2' ' ND2' ' A' ' 546' ' ' ASN . 19.0 t70 -62.57 -44.06 97.27 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.903 0.859 . . . . 0.0 109.187 176.162 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -85.34 156.87 59.51 Favored Pre-proline 0 C--N 1.291 -1.956 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -50.89 112.03 0.68 Allowed 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 122.277 1.984 . . . . 0.0 108.816 173.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -118.46 31.81 6.47 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.636 0.731 . . . . 0.0 110.109 -169.571 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -70.91 -6.09 35.75 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.677 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -66.34 -20.73 66.16 Favored 'General case' 0 C--O 1.214 -0.79 0 C-N-CA 124.984 1.314 . . . . 0.0 109.617 171.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 555' ' ' GLU . . . . . 0.415 ' HG3' HG13 ' A' ' 556' ' ' ILE . 8.8 pt-20 -37.78 -54.29 1.24 Allowed 'General case' 0 C--O 1.204 -1.306 0 C-N-CA 123.798 0.839 . . . . 0.0 113.026 179.733 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 556' ' ' ILE . . . . . 0.415 HG13 ' HG3' ' A' ' 555' ' ' GLU . 20.5 mt -67.61 -42.64 86.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -176.592 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -56.06 -52.46 64.17 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.898 0.748 . . . . 0.0 110.121 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -65.03 -57.88 7.52 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.745 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -50.99 -54.14 27.08 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 124.932 1.293 . . . . 0.0 112.615 -176.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 560' ' ' VAL . . . . . 0.664 ' HB ' HD21 ' A' ' 578' ' ' LEU . 53.1 t -71.52 -40.65 72.0 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.386 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.594 -176.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -60.29 -34.82 74.3 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 117.959 0.345 . . . . 0.0 110.686 178.7 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.26 -36.5 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 121.383 0.611 . . . . 0.0 111.907 177.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.454 HG23 HE21 ' A' ' 469' ' ' GLN . 60.2 mt -84.63 -36.5 11.62 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.01 0 CA-C-O 122.204 1.002 . . . . 0.0 108.328 -176.09 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 564' ' ' ASN . . . . . 0.428 HD21 ' HB2' ' A' ' 575' ' ' ASN . 10.0 t30 -81.56 7.21 12.68 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.348 176.34 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -71.66 -20.3 61.97 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 172.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -95.24 33.6 1.53 Allowed 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 113.925 -1.489 . . . . 0.0 107.383 172.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -75.86 64.58 2.65 Favored Glycine 0 CA--C 1.501 -0.824 0 C-N-CA 124.957 1.265 . . . . 0.0 116.089 -170.653 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -87.88 -178.17 5.96 Favored 'General case' 0 C--N 1.281 -2.404 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 168.673 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -56.36 149.81 15.97 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 118.405 0.548 . . . . 0.0 109.737 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 44.3 m 84.68 -40.87 0.06 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.804 1.242 . . . . 0.0 109.612 -174.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 12.5 mm -88.71 -31.3 5.5 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.053 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -177.187 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -60.24 -15.71 27.17 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 125.17 1.388 . . . . 0.0 110.801 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 9.4 m -63.57 -32.0 73.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 174.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 79.4 mt -66.0 -42.51 89.63 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.711 177.339 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 575' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 578' ' ' LEU . 65.2 t30 -58.33 -43.81 88.39 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.935 0.874 . . . . 0.0 109.328 177.803 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -58.29 -48.49 80.29 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.942 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -60.15 -35.12 74.59 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.287 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.664 HD21 ' HB ' ' A' ' 560' ' ' VAL . 26.6 mt -53.84 -51.98 61.84 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.599 0.238 . . . . 0.0 111.262 174.262 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.427 ' HD2' ' O ' ' A' ' 575' ' ' ASN . 0.0 OUTLIER -60.74 -44.15 97.02 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.226 -179.859 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 580' ' ' GLU . . . . . 0.59 ' O ' ' HG3' ' A' ' 583' ' ' ARG . 37.0 tt0 -68.04 -53.74 23.51 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.728 -178.138 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -60.63 -31.01 70.23 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -179.047 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 582' ' ' THR . . . . . . . . . . . . 0.266 1.8 m -81.36 -26.45 35.52 Favored 'General case' 0 C--O 1.175 -2.846 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 179.072 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.59 ' HG3' ' O ' ' A' ' 580' ' ' GLU 0.267 0.0 OUTLIER -56.95 -24.19 50.98 Favored 'General case' 0 CA--C 1.577 1.992 0 CA-C-O 122.981 1.372 . . . . 0.0 112.207 178.156 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . 0.355 12.7 tt -85.43 65.88 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.101 0 C-N-CA 129.294 3.037 . . . . 0.0 109.365 167.75 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 144.65 68.78 0.02 OUTLIER Glycine 0 C--N 1.351 1.411 0 CA-C-O 125.165 2.536 . . . . 0.0 107.323 -144.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -52.59 172.95 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.268 1 C-N-CA 132.081 4.152 . . . . 0.0 112.136 -163.808 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.1 p -17.21 -3.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.529 3.5 1 C-N-CA 132.409 4.284 . . . . 0.0 119.465 -139.68 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -63.71 -29.33 70.57 Favored 'General case' 0 C--O 1.204 -1.29 0 N-CA-C 103.671 -2.715 . . . . 0.0 103.671 153.798 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 589' ' ' LEU . . . . . 0.427 ' HG ' ' N ' ' A' ' 590' ' ' GLN . 0.1 OUTLIER -49.98 -47.29 52.85 Favored 'General case' 0 C--O 1.197 -1.664 0 C-N-CA 126.825 2.05 . . . . 0.0 110.304 169.965 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 590' ' ' GLN . . . . . 0.427 ' N ' ' HG ' ' A' ' 589' ' ' LEU . 50.0 tt0 -57.64 -47.58 81.85 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 591' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -59.3 -48.12 82.82 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.161 176.232 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -60.29 -40.53 90.79 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -60.29 -43.22 96.48 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 123.429 0.692 . . . . 0.0 110.104 175.087 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.401 ' O ' ' HB ' ' A' ' 597' ' ' ILE . 50.8 tp -60.31 -42.94 96.6 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 122.088 0.947 . . . . 0.0 109.234 175.02 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.519 ' HA ' HG12 ' A' ' 598' ' ' VAL . 97.2 mt-30 -67.66 -26.08 66.03 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.278 178.443 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -68.62 -40.21 80.46 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 174.746 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.401 ' HB ' ' O ' ' A' ' 594' ' ' LEU . 75.8 mt -57.17 -47.72 83.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.101 175.009 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 598' ' ' VAL . . . . . 0.519 HG12 ' HA ' ' A' ' 595' ' ' GLN . 4.3 p -69.64 -28.38 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 120.551 -0.46 . . . . 0.0 111.1 178.712 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.575 ' O ' ' HB3' ' A' ' 602' ' ' LYS . . . -67.22 -37.14 83.11 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.922 0.868 . . . . 0.0 109.766 174.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -68.43 -39.03 81.7 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.316 174.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -64.88 -27.82 69.12 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 121.973 0.892 . . . . 0.0 110.042 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.575 ' HB3' ' O ' ' A' ' 599' ' ' ALA . 3.8 tmtm? -68.41 -49.69 58.15 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 174.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 603' ' ' GLU . . . . . 0.409 ' C ' ' H ' ' A' ' 605' ' ' MET . 47.2 mt-10 -82.71 6.99 16.18 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 179.127 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -71.08 44.65 0.09 Allowed 'General case' 0 CA--C 1.561 1.392 0 CA-C-O 122.858 1.313 . . . . 0.0 110.971 177.539 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 605' ' ' MET . . . . . 0.409 ' H ' ' C ' ' A' ' 603' ' ' GLU . 18.1 ptp . . . . . 0 C--N 1.283 -2.313 0 CA-C-N 114.856 -1.066 . . . . 0.0 108.321 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 32.6 p90 . . . . . 0 C--O 1.247 0.966 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -81.83 163.14 22.54 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.984 177.297 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -127.9 78.39 1.82 Allowed 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 -179.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 7.1 mp -69.65 99.67 1.35 Allowed 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 18.4 m -71.06 135.58 47.82 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -174.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 19.6 mmt85 -60.12 -38.79 84.09 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 123.138 1.447 . . . . 0.0 107.199 173.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.572 ' HG3' ' HA ' ' A' ' 563' ' ' ILE . 18.3 mp0 -64.14 -21.76 66.67 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 112.768 -2.015 . . . . 0.0 111.555 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.66 ' O ' ' HG2' ' A' ' 474' ' ' ARG . 55.3 tt0 -66.28 -40.79 90.32 Favored 'General case' 0 C--O 1.209 -1.047 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -62.58 -41.53 99.0 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -58.17 -46.26 86.04 Favored 'General case' 0 C--O 1.243 0.738 0 O-C-N 123.675 0.609 . . . . 0.0 109.89 175.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -57.57 -50.29 73.59 Favored 'General case' 0 C--O 1.2 -1.548 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.957 175.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.66 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 18.7 mmm-85 -59.18 -32.0 69.51 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 120.77 0.319 . . . . 0.0 110.327 -178.108 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -66.02 -57.59 7.41 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 476' ' ' PHE . . . . . 0.416 ' HB3' ' HB2' ' A' ' 490' ' ' TYR . 1.4 m-85 -62.53 -35.4 79.31 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 178.485 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 25.8 tp -73.17 -9.0 58.25 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 124.941 1.296 . . . . 0.0 112.352 -176.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -46.51 -40.04 11.85 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.207 1.003 . . . . 0.0 113.577 -179.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.956 ' HA ' HG21 ' A' ' 486' ' ' THR 0.256 0.3 OUTLIER 84.76 130.15 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 126.574 1.949 . . . . 0.0 111.753 -177.153 . . . . . . . . 4 4 . 1 . 017 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -93.42 -96.25 0.15 Allowed 'General case' 0 N--CA 1.427 -1.591 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.406 175.188 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 481' ' ' MET . . . . . . . . . . . . 0.398 0.5 OUTLIER -95.84 -91.37 0.22 Allowed 'General case' 0 CA--C 1.472 -2.04 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 179.905 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 482' ' ' ARG . . . . . 0.603 ' HB3' ' O ' ' A' ' 519' ' ' ASP . 12.6 mtm180 -79.04 -100.33 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.668 0 C-N-CA 116.689 -2.004 . . . . 0.0 111.202 -174.405 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 483' ' ' ASP . . . . . 0.593 ' HB3' ' HB2' ' A' ' 519' ' ' ASP . 10.1 t70 -142.46 -54.72 0.43 Allowed 'General case' 0 C--N 1.296 -1.74 0 C-N-CA 123.453 0.701 . . . . 0.0 109.262 173.927 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 34.3 tttm -34.53 -66.45 0.17 Allowed 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 113.046 -1.888 . . . . 0.0 113.746 -170.43 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -58.95 -52.9 63.79 Favored 'General case' 0 C--O 1.202 -1.442 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.546 -173.364 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.956 HG21 ' HA ' ' A' ' 479' ' ' HIS . 93.8 m -61.03 -48.15 83.09 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.778 -177.902 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -54.92 -59.09 5.21 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 124.431 1.082 . . . . 0.0 108.959 -177.036 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 85.0 mt -68.65 -27.64 66.18 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.421 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -64.36 -30.8 71.83 Favored 'General case' 0 CA--C 1.489 -1.375 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 490' ' ' TYR . . . . . 0.448 ' O ' HG23 ' A' ' 494' ' ' VAL . 2.0 t80 -95.53 -53.43 3.74 Favored 'General case' 1 N--CA 1.367 -4.613 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 176.484 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -63.96 -40.24 95.95 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 124.747 1.219 . . . . 0.0 114.146 -167.64 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -81.93 -10.68 59.2 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.436 0.636 . . . . 0.0 112.17 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 17.8 m -84.84 -11.76 54.98 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.05 176.209 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 494' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 490' ' ' TYR . 23.9 t -113.72 109.39 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.863 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.256 -176.824 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -95.23 -17.1 22.0 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -89.56 20.61 3.86 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 113.329 -1.76 . . . . 0.0 111.647 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -58.51 -6.9 0.78 Allowed 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -174.168 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -79.57 -9.82 59.69 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 120.898 -1.126 . . . . 0.0 110.58 176.87 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -82.22 -9.41 59.51 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.783 176.511 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 20.4 p -56.14 160.91 2.66 Favored 'General case' 0 C--O 1.25 1.103 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -174.586 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.712 ' OD1' ' HB2' ' A' ' 503' ' ' HIS . 8.0 p30 -91.64 161.73 14.79 Favored 'General case' 0 N--CA 1.416 -2.145 0 CA-C-N 114.03 -1.441 . . . . 0.0 111.03 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -77.42 -23.31 50.62 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.571 0.7 . . . . 0.0 109.623 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 503' ' ' HIS . . . . . 0.712 ' HB2' ' OD1' ' A' ' 501' ' ' ASN . 32.3 m170 -61.42 -46.24 90.94 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 175.724 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 504' ' ' PHE . . . . . 0.429 ' CE1' ' CE1' ' A' ' 490' ' ' TYR . 72.2 t80 -57.65 -35.43 70.53 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.266 -1.334 . . . . 0.0 111.197 173.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -63.93 -48.85 74.94 Favored 'General case' 0 CA--C 1.482 -1.652 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -175.463 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.495 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.2 OUTLIER -61.32 -37.67 84.09 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 118.283 -1.367 . . . . 0.0 110.17 -179.076 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 507' ' ' VAL . . . . . 0.462 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 23.3 t -66.85 -54.53 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 120.291 -0.563 . . . . 0.0 110.785 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -48.97 -39.87 28.23 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.849 0.86 . . . . 0.0 110.873 176.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -59.52 -56.34 23.2 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.362 1.065 . . . . 0.0 110.376 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 506' ' ' TYR . 2.5 t -64.44 -41.16 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.445 178.376 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 83.7 mt -58.75 -53.78 54.49 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.251 0.548 . . . . 0.0 111.488 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -62.82 -32.13 73.27 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.695 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.32 -40.98 98.12 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 120.773 0.321 . . . . 0.0 110.254 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 514' ' ' PHE . . . . . 0.446 ' CE2' HG12 ' A' ' 510' ' ' VAL . 33.4 m-85 -69.11 -57.09 5.86 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -49.03 -34.53 13.56 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.893 1.277 . . . . 0.0 111.307 -178.488 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.06 -23.97 66.63 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -112.38 -58.01 2.2 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.45 0.643 . . . . 0.0 110.021 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -158.01 121.54 4.01 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 125.345 1.458 . . . . 0.0 108.352 175.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 519' ' ' ASP . . . . . 0.603 ' O ' ' HB3' ' A' ' 482' ' ' ARG . 1.9 p30 -77.78 98.72 5.64 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-O 121.064 0.459 . . . . 0.0 111.698 -172.231 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -143.04 140.97 31.19 Favored 'General case' 0 CA--C 1.491 -1.315 0 O-C-N 121.437 -0.79 . . . . 0.0 110.938 167.826 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -85.0 105.9 16.1 Favored 'General case' 0 N--CA 1.402 -2.864 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 170.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -85.5 110.41 19.18 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -177.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 5.0 tt -55.85 -33.32 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 C-N-CA 124.58 1.152 . . . . 0.0 110.907 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.581 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 48.1 t -58.34 -38.64 77.56 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.083 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -65.26 -43.57 90.84 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -58.11 -52.47 65.43 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.137 179.485 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.587 ' HA ' HG13 ' A' ' 530' ' ' VAL . 8.9 p -67.77 -24.02 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 CA-C-O 121.063 0.459 . . . . 0.0 111.88 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 528' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 524' ' ' SER . 78.0 mt-30 -67.65 -26.62 66.31 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 121.144 -0.972 . . . . 0.0 109.484 172.879 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 526' ' ' ALA . 47.5 m-85 -75.01 -0.49 19.0 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 118.136 -0.935 . . . . 0.0 112.659 174.416 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.637 ' HA ' ' NH1' ' A' ' 536' ' ' ARG . 32.3 m -72.37 20.88 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.532 3.666 0 N-CA-C 116.589 2.07 . . . . 0.0 116.589 -173.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -128.99 -40.5 1.5 Allowed 'General case' 0 C--N 1.278 -2.521 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 173.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.58 -144.62 0.03 OUTLIER 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 128.729 2.812 . . . . 0.0 112.062 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 533' ' ' ASN . . . . . 0.497 ' C ' ' H ' ' A' ' 535' ' ' LEU . 45.3 t30 -27.8 31.42 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 1 C-N-CA 138.496 6.719 . . . . 0.0 117.578 176.817 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -31.76 8.87 0.0 OUTLIER 'General case' 0 N--CA 1.536 3.854 0 C-N-CA 130.992 3.717 . . . . 0.0 117.045 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.497 ' H ' ' C ' ' A' ' 533' ' ' ASN . 45.5 mt -63.76 -26.84 68.82 Favored 'General case' 0 C--N 1.283 -2.295 0 N-CA-C 103.167 -2.901 . . . . 0.0 103.167 162.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.637 ' NH1' ' HA ' ' A' ' 530' ' ' VAL . 1.4 ttp180 -56.27 -39.55 72.81 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 111.887 -2.415 . . . . 0.0 110.985 169.094 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -60.96 -47.04 88.28 Favored 'General case' 0 CA--C 1.481 -1.706 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 -179.044 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.472 ' O ' HD13 ' A' ' 542' ' ' LEU . 24.4 m -55.81 -48.15 75.91 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 114.295 -1.32 . . . . 0.0 109.832 174.853 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 539' ' ' LEU . . . . . 0.552 ' O ' ' HB2' ' A' ' 542' ' ' LEU . 9.3 tt -60.54 -36.71 79.09 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 540' ' ' ILE . . . . . 0.484 HG12 ' O ' ' A' ' 536' ' ' ARG . 50.1 mm -66.88 -34.27 68.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 178.222 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 541' ' ' SER . . . . . 0.443 ' HB3' ' O ' ' A' ' 538' ' ' THR . 29.7 t -57.32 -40.01 77.0 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.104 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.552 ' HB2' ' O ' ' A' ' 539' ' ' LEU . 6.3 mp -60.58 -33.63 73.0 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.527 0.731 . . . . 0.0 109.955 175.665 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -80.08 -31.11 39.36 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -69.71 -33.65 72.8 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -64.01 114.05 3.88 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.256 170.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 82.9 m-20 -107.1 138.22 43.68 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.247 -175.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.558 ' H ' HD23 ' A' ' 547' ' ' LEU . 2.1 pt? -79.8 9.5 5.15 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.288 1.042 . . . . 0.0 110.511 177.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -68.81 -41.41 78.69 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.703 -1.135 . . . . 0.0 108.542 174.338 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -68.36 -60.52 2.38 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.744 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -125.21 119.78 25.12 Favored Pre-proline 0 N--CA 1.425 -1.723 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.276 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 551' ' ' PRO . . . . . 0.486 ' HB2' ' OE1' ' A' ' 553' ' ' GLU . 29.9 Cg_endo -63.49 -169.91 0.1 Allowed 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.233 2.622 . . . . 0.0 114.065 -177.707 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 552' ' ' TYR . . . . . 0.443 ' O ' HG13 ' A' ' 556' ' ' ILE . 47.1 p90 -91.55 -13.65 31.68 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -170.729 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 553' ' ' GLU . . . . . 0.486 ' OE1' ' HB2' ' A' ' 551' ' ' PRO . 2.0 mp0 -66.9 -42.86 84.75 Favored 'General case' 0 C--N 1.28 -2.435 0 CA-C-O 121.304 0.573 . . . . 0.0 110.416 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 554' ' ' ASN . . . . . 0.525 ' HA ' ' HG3' ' A' ' 583' ' ' ARG . 1.9 p-10 -69.16 -24.07 64.03 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.551 175.121 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 555' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 551' ' ' PRO . 54.9 mt-10 -72.39 -46.78 53.72 Favored 'General case' 0 C--O 1.211 -0.927 0 C-N-CA 120.054 -0.658 . . . . 0.0 109.408 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 556' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 552' ' ' TYR . 64.8 mt -58.79 -49.17 83.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.116 0.566 . . . . 0.0 110.865 178.078 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -60.31 -52.53 64.88 Favored 'General case' 0 CA--C 1.508 -0.638 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.58 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -60.24 -43.35 96.17 Favored 'General case' 0 C--O 1.207 -1.161 0 O-C-N 123.862 0.726 . . . . 0.0 110.611 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 559' ' ' TYR . . . . . 0.442 ' O ' HG13 ' A' ' 563' ' ' ILE . 50.4 t80 -54.43 -53.56 52.47 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 124.473 1.109 . . . . 0.0 110.813 176.446 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.9 t -65.21 -42.33 93.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.569 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -62.4 -42.43 99.42 Favored 'General case' 0 C--O 1.194 -1.861 0 C-N-CA 123.456 0.702 . . . . 0.0 110.087 -179.273 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 562' ' ' VAL . . . . . 0.585 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 40.9 t -64.89 -41.21 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 CA-C-O 121.656 0.741 . . . . 0.0 112.679 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.572 ' HA ' ' HG3' ' A' ' 469' ' ' GLN . 54.1 mt -76.32 -35.85 28.3 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.224 0 CA-C-O 122.136 0.969 . . . . 0.0 109.462 -174.778 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -90.93 -6.82 53.58 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.0 -176.728 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 11.8 pt-20 -76.6 -25.03 53.48 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -90.06 12.52 17.48 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.325 176.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -121.22 -55.59 0.23 Allowed Glycine 0 N--CA 1.431 -1.668 0 CA-C-N 115.54 -0.755 . . . . 0.0 112.286 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -87.05 157.35 19.44 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -175.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 569' ' ' GLU . . . . . 0.54 ' HG3' ' H ' ' A' ' 571' ' ' ILE . 9.8 tp10 -60.7 171.16 1.22 Allowed 'General case' 0 CA--C 1.58 2.133 0 C-N-CA 126.458 1.903 . . . . 0.0 113.36 -177.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 36.2 m -78.04 -10.99 59.87 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 124.543 1.137 . . . . 0.0 110.319 -178.606 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.54 ' H ' ' HG3' ' A' ' 569' ' ' GLU . 5.0 mt -86.5 -31.34 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.763 0 N-CA-C 105.772 -1.936 . . . . 0.0 105.772 177.096 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -71.11 -22.2 62.12 Favored 'General case' 0 N--CA 1.4 -2.928 0 CA-C-N 113.584 -1.643 . . . . 0.0 110.389 174.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 52.3 m -61.7 -34.13 75.22 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.709 177.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 7.3 mp -65.11 -47.0 78.72 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 173.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -60.15 -40.29 89.33 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.434 178.198 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 9.2 m170 -57.89 -40.41 80.21 Favored 'General case' 0 C--O 1.197 -1.689 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.424 174.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 577' ' ' LYS . . . . . 0.45 ' O ' ' HB3' ' A' ' 580' ' ' GLU . 40.2 ttmt -63.27 -49.44 74.06 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.103 0.561 . . . . 0.0 111.983 -177.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 8.7 mp -62.19 -43.76 98.1 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.231 0.538 . . . . 0.0 111.484 175.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.694 ' O ' ' HB ' ' A' ' 582' ' ' THR . 12.3 ttm105 -59.7 -34.32 72.75 Favored 'General case' 0 CA--C 1.565 1.553 0 CA-C-O 121.8 0.81 . . . . 0.0 110.73 174.534 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 580' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 577' ' ' LYS . 32.3 tt0 -64.64 -33.41 75.87 Favored 'General case' 0 C--O 1.197 -1.691 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.494 177.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -67.42 -35.35 79.08 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.442 0.639 . . . . 0.0 110.58 172.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.694 ' HB ' ' O ' ' A' ' 579' ' ' ARG . 54.4 m -60.33 -28.42 68.14 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 125.201 1.401 . . . . 0.0 111.192 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.525 ' HG3' ' HA ' ' A' ' 554' ' ' ASN . 25.4 ttm180 -30.25 -34.41 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 127.594 2.358 . . . . 0.0 116.831 176.224 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 13.4 tt -74.36 -10.31 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.585 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -171.603 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 87.95 8.58 72.35 Favored Glycine 0 N--CA 1.477 1.396 0 C-N-CA 120.209 -0.996 . . . . 0.0 112.417 177.049 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -83.69 166.75 17.83 Favored 'General case' 0 C--N 1.284 -2.251 0 C-N-CA 125.45 1.5 . . . . 0.0 110.025 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.575 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 19.9 m -46.92 -6.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.36 1.03 0 C-N-CA 125.942 1.697 . . . . 0.0 114.172 177.431 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.32 -11.78 17.22 Favored 'General case' 0 CA--C 1.562 1.419 0 O-C-N 121.562 -0.711 . . . . 0.0 110.423 166.31 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 589' ' ' LEU . . . . . 0.496 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 9.3 mp -68.91 -36.79 78.43 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 167.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 590' ' ' GLN . . . . . 0.575 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 32.9 tt0 -60.58 -40.09 90.44 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 171.848 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 591' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -69.14 -27.22 65.36 Favored 'General case' 0 C--O 1.207 -1.18 0 CA-C-N 114.462 -1.245 . . . . 0.0 110.314 177.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 592' ' ' TYR . . . . . 0.496 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 62.8 t80 -61.24 -41.65 97.26 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 120.993 0.425 . . . . 0.0 109.875 173.761 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 593' ' ' TYR . . . . . 0.426 ' O ' ' HB3' ' A' ' 596' ' ' GLN . 71.8 t80 -58.88 -42.71 90.13 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 174.336 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 60.7 tp -61.54 -41.86 97.97 Favored 'General case' 0 C--O 1.204 -1.326 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.407 175.42 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -61.92 -29.27 70.11 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.576 0.75 . . . . 0.0 111.947 178.856 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 596' ' ' GLN . . . . . 0.426 ' HB3' ' O ' ' A' ' 593' ' ' TYR . 35.5 tt0 -63.67 -52.81 59.01 Favored 'General case' 0 C--O 1.248 1.012 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 173.897 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 1.8 mp -58.93 -47.68 88.92 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 CA-C-N 114.834 -1.075 . . . . 0.0 111.339 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 71.1 t -60.62 -42.87 93.36 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 C-N-CA 123.206 0.603 . . . . 0.0 111.499 -178.747 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.427 ' O ' ' HE2' ' A' ' 602' ' ' LYS . . . -60.81 -37.37 81.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.862 0.363 . . . . 0.0 110.279 177.575 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -68.39 -41.41 80.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.93 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 601' ' ' ASN . . . . . 0.544 ' O ' ' HB3' ' A' ' 604' ' ' ARG . 67.1 t30 -66.01 -34.24 77.65 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 122.225 1.012 . . . . 0.0 109.984 178.698 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.548 ' HE3' ' HG3' ' A' ' 603' ' ' GLU . 12.4 ttpt -65.42 -44.26 87.96 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.158 177.618 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 603' ' ' GLU . . . . . 0.548 ' HG3' ' HE3' ' A' ' 602' ' ' LYS . 13.2 mt-10 -79.22 -6.87 57.61 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.727 0.811 . . . . 0.0 112.471 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 604' ' ' ARG . . . . . 0.544 ' HB3' ' O ' ' A' ' 601' ' ' ASN . 62.7 ttt180 -77.69 -55.95 4.92 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 123.746 0.818 . . . . 0.0 111.147 177.28 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 68.1 mtm . . . . . 0 C--N 1.308 -1.218 0 CA-C-O 118.605 -0.712 . . . . 0.0 110.265 -176.38 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.434 -1.272 0 CA-C-O 121.59 0.709 . . . . 0.0 111.441 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -118.37 -141.69 0.36 Allowed 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -81.28 -134.02 0.03 OUTLIER 'General case' 0 N--CA 1.414 -2.247 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.017 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 466' ' ' LEU . . . . . 0.424 ' H ' ' HG ' ' A' ' 466' ' ' LEU . 50.5 mt -48.16 129.0 14.86 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 125.447 1.499 . . . . 0.0 110.311 -176.79 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 68.8 p -75.05 178.64 5.51 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.125 -175.064 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 468' ' ' ARG . . . . . 0.463 ' NH2' HG22 ' A' ' 562' ' ' VAL . 8.1 ptm85 -60.18 -40.94 91.77 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.54 ' NE2' ' HA ' ' A' ' 563' ' ' ILE . 67.0 mt-30 -70.36 -30.02 66.84 Favored 'General case' 0 C--O 1.212 -0.88 0 C-N-CA 119.041 -1.064 . . . . 0.0 111.429 176.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.533 ' HG2' HG22 ' A' ' 500' ' ' THR . 48.5 mt-10 -70.72 -35.19 72.61 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 120.777 0.323 . . . . 0.0 111.104 176.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.489 ' HD3' ' HA ' ' A' ' 471' ' ' LYS . 20.5 mmtp -66.93 -33.45 75.61 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.834 173.29 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.0 -47.17 60.35 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.91 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 473' ' ' GLU . . . . . 0.404 ' OE2' HG21 ' A' ' 494' ' ' VAL . 5.0 mm-40 -61.44 -44.44 97.1 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 120.515 0.198 . . . . 0.0 110.617 176.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.497 ' NE ' ' HB3' ' A' ' 542' ' ' LEU . 11.7 tpt180 -54.88 -42.23 71.84 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.778 173.887 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 475' ' ' ALA . . . . . 0.455 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . . . -64.43 -44.93 89.64 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-O 120.799 0.333 . . . . 0.0 110.692 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.24 -18.69 64.78 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.2 mt -71.08 -15.96 62.55 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 121.953 -0.467 . . . . 0.0 112.07 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.455 ' HE3' ' HA ' ' A' ' 475' ' ' ALA . 10.0 mtmp? -77.78 26.15 0.19 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 122.984 0.514 . . . . 0.0 111.747 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 -86.88 14.0 8.03 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 122.881 0.472 . . . . 0.0 111.959 -175.164 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 97.1 mt 71.35 -174.55 0.17 Allowed 'General case' 0 C--O 1.245 0.863 0 C-N-CA 123.754 0.821 . . . . 0.0 110.729 -177.459 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 59.0 ttp -88.26 -36.31 16.79 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.86 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 25.2 ttp180 -57.48 -46.67 83.43 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.914 1.286 . . . . 0.0 114.313 -173.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.3 59.29 0.27 Allowed 'General case' 0 C--N 1.28 -2.422 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -171.59 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -57.55 -36.76 72.06 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 124.319 1.047 . . . . 0.0 111.54 177.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -57.19 -44.05 83.24 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.117 0.484 . . . . 0.0 109.702 176.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 28.9 m -64.6 -31.63 72.93 Favored 'General case' 0 N--CA 1.421 -1.911 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.231 -178.981 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -61.03 -50.93 71.33 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 488' ' ' LEU . . . . . 0.467 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 76.1 mt -74.33 -36.75 63.68 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.514 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -61.32 -42.96 99.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.276 0.63 . . . . 0.0 112.431 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -78.57 -38.58 39.91 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.636 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -55.19 -49.28 72.31 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.82 178.647 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 492' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 12.6 pt-20 -79.29 -7.69 58.49 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -177.769 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 68.9 m -81.4 -14.88 56.65 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 122.121 0.962 . . . . 0.0 109.132 174.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 494' ' ' VAL . . . . . 0.578 HG13 ' HB2' ' A' ' 497' ' ' ASP . 33.1 t -100.08 133.78 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.376 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -149.5 -56.63 0.19 Allowed 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -88.46 -22.38 23.71 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 122.727 1.251 . . . . 0.0 108.347 178.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 497' ' ' ASP . . . . . 0.578 ' HB2' HG13 ' A' ' 494' ' ' VAL . 0.0 OUTLIER -72.96 -2.88 22.73 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 126.689 1.996 . . . . 0.0 109.365 178.191 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -77.68 22.51 0.26 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.147 0.979 . . . . 0.0 109.855 -176.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 499' ' ' PHE . . . . . 0.476 ' HE1' ' OE1' ' A' ' 469' ' ' GLN . 31.5 p90 -77.68 -9.75 59.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 500' ' ' THR . . . . . 0.533 HG22 ' HG2' ' A' ' 470' ' ' GLU . 1.1 p -54.48 166.97 0.37 Allowed 'General case' 0 N--CA 1.426 -1.661 0 C-N-CA 125.999 1.72 . . . . 0.0 115.115 -173.959 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.453 ' HB2' ' OE2' ' A' ' 470' ' ' GLU . 16.0 t-20 -64.38 146.99 53.57 Favored 'General case' 0 N--CA 1.429 -1.511 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.024 -175.042 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -64.05 -15.43 59.47 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-O 120.97 0.414 . . . . 0.0 111.306 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 503' ' ' HIS . . . . . 0.495 ' NE2' ' HG ' ' A' ' 535' ' ' LEU . 66.6 m170 -65.54 -39.03 91.28 Favored 'General case' 0 C--O 1.203 -1.36 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.448 176.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -63.89 -36.62 84.54 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.508 0.67 . . . . 0.0 110.32 176.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -68.11 -41.33 81.91 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.783 176.545 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 506' ' ' TYR . . . . . 0.459 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -60.81 -40.37 92.45 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.19 177.29 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 507' ' ' VAL . . . . . 0.464 ' O ' HD13 ' A' ' 511' ' ' LEU . 77.1 t -56.42 -56.47 13.48 Favored 'Isoleucine or valine' 0 C--N 1.341 0.217 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 173.622 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -45.62 -52.53 10.54 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 123.96 0.787 . . . . 0.0 111.747 174.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.47 -60.09 4.17 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 123.812 0.845 . . . . 0.0 112.539 -177.934 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 510' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 506' ' ' TYR . 17.0 t -60.78 -43.71 95.9 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 CA-C-O 120.512 0.196 . . . . 0.0 110.99 -176.327 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.464 HD13 ' O ' ' A' ' 507' ' ' VAL . 10.8 mp -63.32 -49.66 73.08 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.062 -178.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -64.18 -35.9 82.29 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 123.86 0.725 . . . . 0.0 110.856 -177.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -60.98 -44.28 97.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.822 0.344 . . . . 0.0 111.523 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -74.48 -47.21 34.64 Favored 'General case' 0 C--O 1.183 -2.409 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 515' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 14.6 t80 -47.83 -37.41 13.75 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 125.674 1.59 . . . . 0.0 110.777 -179.407 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.56 -40.09 88.84 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -115.87 -40.6 3.31 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -172.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -106.02 -151.57 0.46 Allowed 'General case' 0 C--N 1.271 -2.83 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 519' ' ' ASP . . . . . 0.403 ' CG ' ' H ' ' A' ' 520' ' ' GLN . 13.7 t70 -105.17 -160.11 0.74 Allowed 'General case' 0 C--N 1.285 -2.228 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -177.331 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 520' ' ' GLN . . . . . 0.403 ' H ' ' CG ' ' A' ' 519' ' ' ASP . 88.2 mt-30 -78.04 166.86 22.3 Favored 'General case' 0 C--N 1.296 -1.753 0 C-N-CA 123.164 0.585 . . . . 0.0 112.359 -174.147 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -90.07 134.38 34.29 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 125.314 1.445 . . . . 0.0 111.511 -172.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.14 176.24 5.4 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.105 177.455 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 523' ' ' ILE . . . . . 0.601 HD13 ' H ' ' A' ' 523' ' ' ILE 0.303 0.2 OUTLIER -78.95 -14.16 13.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 119.25 -0.98 . . . . 0.0 113.379 -175.859 . . . . . . . . 4 4 . 1 . 018 nuclear build full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 40.9 m -60.37 -36.0 77.03 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 121.228 0.537 . . . . 0.0 109.589 169.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -66.03 -43.32 87.92 Favored 'General case' 0 C--O 1.253 1.286 0 CA-C-O 122.362 1.077 . . . . 0.0 108.207 176.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.465 ' O ' ' HD3' ' A' ' 536' ' ' ARG . . . -56.15 -52.54 64.01 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 113.675 -1.602 . . . . 0.0 111.658 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.694 ' O ' HG12 ' A' ' 530' ' ' VAL . 8.0 p -64.46 -30.67 50.83 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.928 0 CA-C-O 120.546 0.212 . . . . 0.0 111.026 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 81.3 mm-40 -66.83 -22.94 65.99 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.404 -0.81 . . . . 0.0 110.474 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.14 -3.18 41.18 Favored 'General case' 0 N--CA 1.441 -0.916 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 174.543 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.694 HG12 ' O ' ' A' ' 527' ' ' VAL 0.267 8.9 p -74.67 53.84 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.553 0 CA-C-O 122.918 1.342 . . . . 0.0 113.267 179.039 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -107.16 -33.99 7.27 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 14.7 t -91.77 109.23 20.55 Favored 'General case' 0 N--CA 1.421 -1.893 0 N-CA-C 102.278 -3.23 . . . . 0.0 102.278 163.772 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 20.5 m120 -62.62 -68.2 0.35 Allowed 'General case' 0 C--O 1.203 -1.369 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 -170.328 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -37.44 23.71 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 114.398 1.259 . . . . 0.0 114.398 -177.738 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.495 ' HG ' ' NE2' ' A' ' 503' ' ' HIS . 6.6 tt -62.06 -68.01 0.36 Allowed 'General case' 0 C--O 1.266 1.928 0 C-N-CA 124.19 0.996 . . . . 0.0 109.897 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.465 ' HD3' ' O ' ' A' ' 526' ' ' ALA . 3.7 tpm_? -69.86 -31.29 69.05 Favored 'General case' 0 N--CA 1.412 -2.33 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.843 -175.9 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -56.06 -58.34 8.35 Favored 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.9 0.75 . . . . 0.0 110.056 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 75.5 m -56.38 -49.04 75.58 Favored 'General case' 0 N--CA 1.443 -0.808 0 O-C-N 123.484 0.49 . . . . 0.0 111.018 178.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 20.1 tp -62.73 -32.81 74.0 Favored 'General case' 0 CA--C 1.568 1.648 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.837 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 24.1 mm -68.39 -41.39 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 174.817 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 19.5 m -55.35 -48.65 73.91 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.593 0.711 . . . . 0.0 109.597 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.497 ' HB3' ' NE ' ' A' ' 474' ' ' ARG . 7.8 mp -66.5 -19.69 65.85 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.112 178.07 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -87.89 -35.34 17.78 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 122.766 0.426 . . . . 0.0 111.927 175.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -69.46 -40.51 77.1 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.163 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -72.06 115.92 11.85 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 121.552 0.691 . . . . 0.0 111.591 173.944 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -98.31 93.67 6.34 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.607 -172.07 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 6.6 mp -83.0 -17.22 44.15 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.775 177.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -77.16 9.17 3.25 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -176.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -69.84 -21.99 63.32 Favored 'General case' 0 CA--C 1.495 -1.149 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 168.046 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -88.11 121.49 70.5 Favored Pre-proline 0 N--CA 1.411 -2.395 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.02 105.54 0.17 Allowed 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.151 1.901 . . . . 0.0 108.623 173.466 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 552' ' ' TYR . . . . . 0.655 ' HB2' ' HB3' ' A' ' 555' ' ' GLU . 4.2 p90 -77.25 40.11 0.26 Allowed 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 -168.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.82 -48.04 64.56 Favored 'General case' 0 C--N 1.266 -3.046 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.603 -179.414 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -69.07 -27.22 65.43 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.736 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 555' ' ' GLU . . . . . 0.655 ' HB3' ' HB2' ' A' ' 552' ' ' TYR . 29.6 tt0 -68.85 -38.39 79.76 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.237 -177.238 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 556' ' ' ILE . . . . . 0.593 HG13 ' O ' ' A' ' 552' ' ' TYR . 62.5 mt -64.52 -45.57 95.26 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.332 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 176.149 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -59.57 -43.24 93.67 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 120.887 0.375 . . . . 0.0 110.686 178.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 558' ' ' ASP . . . . . 0.571 ' O ' HG23 ' A' ' 562' ' ' VAL . 27.5 t70 -62.54 -55.24 29.2 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.812 175.165 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 559' ' ' TYR . . . . . 0.437 ' O ' HG12 ' A' ' 563' ' ' ILE . 40.6 t80 -48.28 -53.02 18.73 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 125.426 1.49 . . . . 0.0 110.759 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 48.6 t -55.99 -50.98 66.32 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.798 0 O-C-N 124.04 0.837 . . . . 0.0 109.524 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.546 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 58.5 t30 -57.95 -42.77 85.64 Favored 'General case' 0 C--O 1.193 -1.915 0 CA-C-N 117.788 0.267 . . . . 0.0 110.812 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 562' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 558' ' ' ASP . 99.1 t -62.47 -36.39 74.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 C-N-CA 124.031 0.933 . . . . 0.0 112.403 -178.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.54 ' HA ' ' NE2' ' A' ' 469' ' ' GLN . 50.8 mm -88.08 -41.86 14.58 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.929 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 -173.666 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 564' ' ' ASN . . . . . 0.434 HD21 ' CG ' ' A' ' 572' ' ' GLU . 66.3 t30 -85.38 18.02 2.88 Favored 'General case' 0 N--CA 1.423 -1.789 0 CA-C-N 112.946 -1.934 . . . . 0.0 110.274 -176.534 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.546 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 51.6 mt-10 -72.65 -16.05 61.71 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.199 -2.149 . . . . 0.0 105.199 165.846 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -95.45 25.71 4.29 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 113.444 -1.707 . . . . 0.0 109.942 174.088 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -137.61 -66.91 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 70.77 157.93 0.18 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.826 1.25 . . . . 0.0 113.938 176.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -69.18 104.99 2.33 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -173.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 570' ' ' THR . . . . . 0.454 HG23 ' H ' ' A' ' 571' ' ' ILE . 5.4 t -165.72 -54.35 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 105.539 -2.023 . . . . 0.0 105.539 175.125 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.454 ' H ' HG23 ' A' ' 570' ' ' THR . 4.8 tp -93.01 -38.43 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.749 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 168.214 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 572' ' ' GLU . . . . . 0.434 ' CG ' HD21 ' A' ' 564' ' ' ASN . 44.5 mm-40 -68.68 -13.1 62.15 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 114.179 -1.373 . . . . 0.0 112.924 -178.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 573' ' ' SER . . . . . 0.457 ' O ' ' HD2' ' A' ' 577' ' ' LYS . 15.2 p -64.33 -38.54 91.41 Favored 'General case' 0 N--CA 1.418 -2.039 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 175.821 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.6 ' HA ' ' HG3' ' A' ' 602' ' ' LYS . 7.0 mp -62.3 -49.75 74.39 Favored 'General case' 0 CA--C 1.498 -1.043 0 CA-C-O 122.72 1.248 . . . . 0.0 110.605 176.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 575' ' ' ASN . . . . . 0.665 ' O ' ' HB3' ' A' ' 578' ' ' LEU . 54.0 t30 -62.96 -31.42 72.53 Favored 'General case' 0 C--N 1.247 -3.881 0 CA-C-N 113.186 -1.825 . . . . 0.0 111.131 178.546 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . 0.37 24.2 m170 -63.75 -31.82 73.12 Favored 'General case' 0 C--N 1.287 -2.14 0 O-C-N 120.157 -1.59 . . . . 0.0 112.507 168.63 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 577' ' ' LYS . . . . . 0.628 ' O ' ' HB3' ' A' ' 580' ' ' GLU . 0.9 OUTLIER -66.92 -24.72 66.12 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.447 0.641 . . . . 0.0 110.892 171.391 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.665 ' HB3' ' O ' ' A' ' 575' ' ' ASN . 3.4 tm? -57.13 -45.81 83.21 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 168.137 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.442 ' HB3' ' OE1' ' A' ' 588' ' ' GLU . 24.5 mtp85 -60.46 -29.2 68.89 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.693 0.759 . . . . 0.0 112.742 175.094 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 580' ' ' GLU . . . . . 0.628 ' HB3' ' O ' ' A' ' 577' ' ' LYS . 1.7 tm-20 -57.76 -42.79 84.72 Favored 'General case' 0 C--N 1.299 -1.625 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 174.534 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -65.45 -31.62 72.8 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-O 121.403 0.621 . . . . 0.0 111.701 171.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.507 ' C ' ' H ' ' A' ' 584' ' ' ILE . 23.8 m -61.74 -22.45 65.4 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 126.344 1.857 . . . . 0.0 112.582 178.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.535 ' HA ' ' HB2' ' A' ' 588' ' ' GLU . 12.6 ptp180 -41.44 7.86 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 115.906 1.817 . . . . 0.0 115.906 172.923 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.507 ' H ' ' C ' ' A' ' 582' ' ' THR . 31.7 pt -77.52 12.89 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 124.909 1.284 . . . . 0.0 112.263 -178.03 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 129.92 6.53 4.01 Favored Glycine 0 N--CA 1.477 1.404 0 C-N-CA 119.469 -1.348 . . . . 0.0 115.242 171.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 586' ' ' ASP . . . . . 0.603 ' C ' ' H ' ' A' ' 588' ' ' GLU . 35.2 t0 -85.01 167.98 15.35 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 169.755 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.52 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 6.1 t -54.35 16.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.584 2.254 0 C-N-CA 128.636 2.774 . . . . 0.0 112.299 -176.518 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.603 ' H ' ' C ' ' A' ' 586' ' ' ASP . 24.0 mm-40 -65.29 6.16 0.31 Allowed 'General case' 0 C--N 1.27 -2.859 0 C-N-CA 126.361 1.864 . . . . 0.0 114.05 -175.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 589' ' ' LEU . . . . . 0.482 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 58.5 tp -76.92 -42.47 39.31 Favored 'General case' 0 C--O 1.265 1.909 0 N-CA-C 105.989 -1.856 . . . . 0.0 105.989 166.011 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 590' ' ' GLN . . . . . 0.52 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 35.6 tt0 -56.63 -49.42 75.04 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 112.986 -1.916 . . . . 0.0 107.765 173.531 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.458 ' HB2' ' HA ' ' A' ' 588' ' ' GLU . 0.2 OUTLIER -78.21 -17.64 56.49 Favored 'General case' 0 C--O 1.201 -1.46 0 CA-C-N 114.648 -1.16 . . . . 0.0 111.27 178.415 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 592' ' ' TYR . . . . . 0.508 ' HA ' ' HG3' ' A' ' 595' ' ' GLN . 88.0 t80 -56.37 -44.52 80.25 Favored 'General case' 0 CA--C 1.478 -1.789 0 C-N-CA 123.604 0.761 . . . . 0.0 109.193 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 593' ' ' TYR . . . . . 0.535 ' O ' HD13 ' A' ' 597' ' ' ILE . 73.6 t80 -57.38 -51.47 69.26 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.463 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.5 -42.56 87.9 Favored 'General case' 0 C--O 1.251 1.155 0 CA-C-O 122.497 1.141 . . . . 0.0 111.575 -178.581 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.508 ' HG3' ' HA ' ' A' ' 592' ' ' TYR 0.301 1.3 pp0? -75.06 -42.62 56.54 Favored 'General case' 0 C--O 1.158 -3.726 0 CA-C-O 117.596 -1.192 . . . . 0.0 112.854 -177.073 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -63.59 -47.87 79.7 Favored 'General case' 0 CA--C 1.495 -1.171 0 CA-C-N 119.31 0.959 . . . . 0.0 111.468 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.535 HD13 ' O ' ' A' ' 593' ' ' TYR . 1.8 mp -57.19 -61.09 1.39 Allowed 'Isoleucine or valine' 0 C--O 1.27 2.181 0 CA-C-O 122.909 1.338 . . . . 0.0 110.193 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 598' ' ' VAL . . . . . 0.523 ' HB ' ' HZ1' ' A' ' 577' ' ' LYS . 45.3 t -72.1 -17.03 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.339 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.858 -175.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.457 ' HA ' ' HD3' ' A' ' 577' ' ' LYS . . . -63.0 -41.97 99.73 Favored 'General case' 0 CA--C 1.468 -2.206 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 175.549 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 600' ' ' LYS . . . . . 0.676 ' O ' ' HB2' ' A' ' 604' ' ' ARG . 87.7 tttt -61.14 -50.39 73.37 Favored 'General case' 0 N--CA 1.422 -1.867 0 O-C-N 124.527 1.142 . . . . 0.0 108.603 178.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -65.68 -40.96 92.91 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.6 ' HG3' ' HA ' ' A' ' 574' ' ' LEU . 4.4 tmtt? -67.03 -56.54 9.64 Favored 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 123.917 0.887 . . . . 0.0 108.812 -177.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -79.11 -2.92 42.94 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.032 -176.001 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 604' ' ' ARG . . . . . 0.676 ' HB2' ' O ' ' A' ' 600' ' ' LYS . 32.9 ttt180 -68.75 -12.12 61.09 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 123.526 0.73 . . . . 0.0 110.295 178.151 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 16.0 tpt . . . . . 0 C--N 1.306 -1.294 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 179.061 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 18.6 p90 . . . . . 0 N--CA 1.412 -2.336 0 CA-C-O 122.027 0.918 . . . . 0.0 110.565 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.76 79.57 1.78 Allowed 'General case' 0 C--N 1.278 -2.5 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 174.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -127.97 56.71 1.58 Allowed 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.579 -177.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 84.0 mt -72.44 91.06 1.34 Allowed 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 170.369 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 12.9 m -60.75 176.65 0.37 Allowed 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -170.403 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -54.73 -17.63 3.69 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.684 1.993 . . . . 0.0 113.214 -175.655 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -53.07 -44.84 67.8 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 123.188 0.305 . . . . 0.0 110.986 177.236 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 470' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 38.1 tt0 -66.31 -30.76 71.24 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 119.511 -0.876 . . . . 0.0 111.046 -178.523 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 471' ' ' LYS . . . . . 0.462 ' HD3' HH21 ' A' ' 474' ' ' ARG . 27.8 tptp -64.62 -33.01 74.93 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.591 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -67.8 -44.86 76.37 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 473' ' ' GLU . . . . . 0.434 ' HB3' ' CE2' ' A' ' 504' ' ' PHE . 1.4 mp0 -56.64 -46.16 81.16 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.074 0.464 . . . . 0.0 110.529 172.837 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 37.7 mtm-85 -62.81 -37.7 87.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.384 -179.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 475' ' ' ALA . . . . . 0.654 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -72.13 -39.2 69.0 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 120.87 0.367 . . . . 0.0 110.927 176.831 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -63.56 -39.51 94.59 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-O 121.682 0.753 . . . . 0.0 110.797 -179.061 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 25.2 tp -71.78 -17.44 62.18 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.788 -1.096 . . . . 0.0 113.67 -173.904 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.654 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 19.5 pttp -70.78 -11.11 60.75 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -177.009 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -122.93 90.79 3.36 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.629 ' HA ' ' HB2' ' A' ' 483' ' ' ASP . 4.2 tt -143.02 71.22 1.33 Allowed 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.781 0.8 . . . . 0.0 109.266 177.666 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 65.0 mtt -97.15 -88.73 0.29 Allowed 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.561 177.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -72.31 -9.06 58.0 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.276 1.431 . . . . 0.0 109.616 174.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 483' ' ' ASP . . . . . 0.629 ' HB2' ' HA ' ' A' ' 480' ' ' LEU . 5.5 m-20 -69.18 37.48 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 128.411 2.685 . . . . 0.0 116.136 -166.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -53.41 -40.13 64.86 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 121.704 0.764 . . . . 0.0 109.983 172.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -60.0 -49.77 76.38 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.681 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 486' ' ' THR . . . . . 0.578 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 7.1 m -59.95 -42.18 93.47 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.101 0.96 . . . . 0.0 110.773 -178.866 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -54.79 -51.32 66.12 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 81.1 mt -68.68 -29.7 68.2 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.4 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -68.97 -34.26 75.02 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.778 0.323 . . . . 0.0 111.134 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -85.27 -40.14 16.93 Favored 'General case' 0 N--CA 1.419 -2.014 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -67.8 -35.15 78.13 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -77.48 -21.9 52.13 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 120.871 0.367 . . . . 0.0 110.525 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 64.5 m -83.8 -8.6 59.19 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.32 0.581 . . . . 0.0 111.76 -175.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 494' ' ' VAL . . . . . 0.427 HG22 ' OD1' ' A' ' 498' ' ' ASN . 0.3 OUTLIER -92.97 153.44 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.638 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -176.642 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -155.26 -105.69 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -172.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 496' ' ' LYS . . . . . 0.431 ' C ' ' H ' ' A' ' 498' ' ' ASN . 38.8 ttpt -90.3 -37.88 13.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.453 0.644 . . . . 0.0 110.533 178.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -75.28 30.84 0.1 Allowed 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 126.04 1.736 . . . . 0.0 112.322 -174.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 498' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 496' ' ' LYS . 6.0 m-20 -73.14 36.11 0.08 Allowed 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 126.779 2.032 . . . . 0.0 111.355 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -65.79 -13.06 58.72 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.258 -178.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 15.9 m -55.15 149.84 11.73 Favored 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 124.418 1.087 . . . . 0.0 108.743 173.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -65.58 155.23 36.42 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.615 -0.678 . . . . 0.0 112.032 -174.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -66.64 5.92 0.54 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.135 0.493 . . . . 0.0 111.894 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 503' ' ' HIS . . . . . 0.483 ' O ' HG23 ' A' ' 507' ' ' VAL . 1.5 m-70 -54.51 -51.78 64.04 Favored 'General case' 0 C--O 1.203 -1.353 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 172.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 504' ' ' PHE . . . . . 0.434 ' CE2' ' HB3' ' A' ' 473' ' ' GLU . 94.2 m-85 -65.15 -27.3 68.63 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.967 -1.015 . . . . 0.0 113.182 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -68.14 -44.23 76.5 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -38.5 89.13 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 119.787 -0.765 . . . . 0.0 109.677 177.806 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 507' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 503' ' ' HIS . 22.1 t -62.18 -47.11 94.66 Favored 'Isoleucine or valine' 0 C--N 1.354 0.778 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -47.78 -45.72 29.67 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.697 0.799 . . . . 0.0 111.235 173.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -60.05 -53.19 60.71 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.445 -179.253 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 18.5 t -58.87 -48.1 87.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 123.406 0.442 . . . . 0.0 109.945 178.225 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 511' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 97.1 mt -54.46 -56.53 17.78 Favored 'General case' 0 C--O 1.211 -0.971 0 O-C-N 124.067 0.854 . . . . 0.0 110.545 -178.231 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -60.3 -30.96 69.83 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 123.996 0.918 . . . . 0.0 110.774 -177.548 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.49 -46.66 66.09 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.597 -178.194 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . 0.251 11.2 p90 -82.83 -28.61 30.05 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 119.399 -0.92 . . . . 0.0 111.049 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -51.71 -35.67 43.9 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.802 1.241 . . . . 0.0 108.779 174.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -59.47 -28.83 67.35 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.036 -0.983 . . . . 0.0 111.234 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -103.36 -59.57 1.69 Allowed 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.485 179.222 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 20.9 m120 -157.38 122.18 4.43 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.279 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -90.87 96.95 10.89 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -174.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -142.27 124.23 15.29 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 161.583 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -67.97 129.24 39.31 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 119.45 1.023 . . . . 0.0 110.497 179.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -113.35 132.24 55.66 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.405 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 35.4 pt -78.47 -13.03 13.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.186 0 CA-C-O 121.17 0.51 . . . . 0.0 110.484 -177.75 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 524' ' ' SER . . . . . 0.555 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 33.1 t -58.17 -41.01 82.92 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.373 174.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -65.55 -35.86 82.08 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 108.901 -0.778 . . . . 0.0 108.901 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -60.71 -50.32 73.94 Favored 'General case' 0 C--O 1.213 -0.833 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.311 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 11.9 p -71.17 -18.02 20.27 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.868 -0.52 . . . . 0.0 111.006 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 528' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.4 mm100 -68.04 -39.78 83.0 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 170.947 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.52 ' CB ' ' HG3' ' A' ' 536' ' ' ARG . 8.1 m-85 -72.36 13.9 0.29 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.146 1.378 . . . . 0.0 112.894 176.596 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.758 ' HA ' ' NH2' ' A' ' 536' ' ' ARG . 8.7 p -72.74 18.4 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.592 2.585 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.453 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -129.16 -49.27 1.2 Allowed 'General case' 0 N--CA 1.479 0.991 0 O-C-N 120.953 -1.092 . . . . 0.0 109.714 176.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 27.4 t -76.04 -144.42 0.02 OUTLIER 'General case' 0 CA--C 1.578 2.036 0 C-N-CA 126.806 2.042 . . . . 0.0 112.349 -176.02 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 533' ' ' ASN . . . . . 0.481 ' C ' ' H ' ' A' ' 535' ' ' LEU . 2.0 t-20 -28.45 30.42 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.978 1 C-N-CA 138.831 6.853 . . . . 0.0 117.419 179.072 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -32.32 9.92 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.221 1 C-N-CA 131.762 4.025 . . . . 0.0 116.891 179.706 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.481 ' H ' ' C ' ' A' ' 533' ' ' ASN . 40.9 mt -63.51 -29.36 70.64 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 102.474 -3.158 . . . . 0.0 102.474 162.051 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.758 ' NH2' ' HA ' ' A' ' 530' ' ' VAL . 0.4 OUTLIER -54.27 -36.92 64.13 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 111.897 -2.411 . . . . 0.0 110.279 170.617 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -72.22 -37.24 69.24 Favored 'General case' 0 CA--C 1.483 -1.611 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -175.06 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 5.9 m -59.64 -40.98 89.44 Favored 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 118.837 -1.145 . . . . 0.0 108.965 170.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 63.8 tp -59.99 -34.51 73.42 Favored 'General case' 0 C--O 1.215 -0.734 0 O-C-N 121.619 -0.676 . . . . 0.0 111.676 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 53.0 mt -61.97 -35.12 66.49 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.261 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 5.5 p -58.3 -43.96 88.34 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 8.2 mp -64.78 -41.15 96.07 Favored 'General case' 0 N--CA 1.487 1.42 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.175 176.653 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -61.97 -35.42 78.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.173 0.989 . . . . 0.0 108.85 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 544' ' ' GLN . . . . . 0.494 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 53.4 tt0 -74.05 39.97 0.12 Allowed 'General case' 0 CA--C 1.567 1.606 0 CA-C-O 122.656 1.217 . . . . 0.0 111.209 177.066 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -75.05 157.08 35.41 Favored 'General case' 0 C--N 1.279 -2.47 0 O-C-N 120.949 -1.095 . . . . 0.0 111.086 177.122 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -102.73 -178.01 3.55 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.717 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.606 ' O ' ' HG3' ' A' ' 550' ' ' GLU . 92.2 mt -76.27 18.96 0.26 Allowed 'General case' 0 C--O 1.208 -1.111 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -173.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 548' ' ' ASN . . . . . 0.487 ' O ' ' HD2' ' A' ' 552' ' ' TYR . 31.3 p-10 -75.02 -8.5 56.71 Favored 'General case' 0 C--N 1.317 -0.836 0 O-C-N 121.934 -0.479 . . . . 0.0 110.974 179.587 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -70.15 0.86 5.45 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.927 0.891 . . . . 0.0 112.35 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.606 ' HG3' ' O ' ' A' ' 547' ' ' LEU . 45.8 mt-10 -55.08 133.35 68.29 Favored Pre-proline 0 C--O 1.239 0.544 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_exo 5.16 61.01 0.0 OUTLIER 'Trans proline' 0 C--N 1.376 1.994 1 C-N-CA 126.843 5.029 . . . . 0.0 115.878 -166.496 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 552' ' ' TYR . . . . . 0.62 ' O ' ' HG3' ' A' ' 555' ' ' GLU . 1.6 t80 -99.83 21.17 12.94 Favored 'General case' 0 C--O 1.205 -1.248 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 -175.186 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -68.35 11.1 0.18 Allowed 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -174.806 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 554' ' ' ASN . . . . . 0.55 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 6.9 t30 -75.18 -20.6 59.23 Favored 'General case' 0 C--O 1.17 -3.098 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 171.184 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 555' ' ' GLU . . . . . 0.62 ' HG3' ' O ' ' A' ' 552' ' ' TYR . 51.3 mt-10 -35.49 -46.04 0.37 Allowed 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 114.517 1.302 . . . . 0.0 114.517 -176.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 59.5 mt -58.78 -38.48 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 CA-C-N 118.28 0.491 . . . . 0.0 110.714 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 557' ' ' ASP . . . . . 0.55 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 3.4 t70 -59.54 -54.59 44.76 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.984 0.914 . . . . 0.0 108.808 176.781 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 558' ' ' ASP . . . . . 0.605 ' O ' HG23 ' A' ' 562' ' ' VAL . 12.8 m-20 -58.52 -53.92 52.83 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.006 177.71 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 559' ' ' TYR . . . . . 0.536 ' O ' HD13 ' A' ' 563' ' ' ILE . 63.3 t80 -51.86 -53.28 42.27 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 126.815 2.046 . . . . 0.0 111.881 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 49.3 t -59.84 -41.39 85.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 561' ' ' ASN . . . . . 0.624 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 8.0 t30 -60.89 -59.73 4.92 Favored 'General case' 0 C--O 1.193 -1.906 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.558 175.227 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 562' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 558' ' ' ASP . 60.1 t -55.07 -36.98 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 C-N-CA 124.074 0.949 . . . . 0.0 112.714 -172.753 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.536 HD13 ' O ' ' A' ' 559' ' ' TYR . 1.6 mp -80.15 -40.61 20.35 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.544 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.917 -172.419 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 564' ' ' ASN . . . . . 0.491 ' HB3' HD21 ' A' ' 574' ' ' LEU . 18.9 t-20 -95.45 7.09 47.25 Favored 'General case' 0 N--CA 1.416 -2.167 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.869 -176.099 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.624 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 52.5 mt-10 -71.67 -23.68 61.71 Favored 'General case' 0 C--N 1.368 1.391 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 170.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -70.45 56.61 0.17 Allowed 'General case' 0 CA--C 1.557 1.224 0 CA-C-N 113.902 -1.499 . . . . 0.0 114.324 -176.453 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -131.04 -114.66 1.66 Allowed Glycine 0 N--CA 1.435 -1.375 0 N-CA-C 108.113 -1.995 . . . . 0.0 108.113 173.61 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 568' ' ' GLN . . . . . 0.4 ' C ' ' H ' ' A' ' 570' ' ' THR . 57.4 tp60 -153.8 -78.94 0.1 Allowed 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 173.066 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -87.06 32.33 0.69 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 177.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 570' ' ' THR . . . . . 0.435 ' O ' ' HG ' ' A' ' 574' ' ' LEU . 9.7 m -107.07 -14.76 14.85 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.014 -167.215 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 571' ' ' ILE . . . . . 0.5 ' O ' ' HB2' ' A' ' 574' ' ' LEU . 6.3 mt -79.83 -37.26 17.92 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.748 0 CA-C-O 121.861 0.839 . . . . 0.0 110.355 -168.741 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 572' ' ' GLU . . . . . 0.469 ' OE1' ' HD2' ' A' ' 604' ' ' ARG . 41.7 mt-10 -83.02 -25.07 32.52 Favored 'General case' 0 N--CA 1.405 -2.711 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.944 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 19.3 m -65.36 -28.97 69.66 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 174.437 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 571' ' ' ILE . 82.1 mt -57.69 -37.5 73.57 Favored 'General case' 0 C--O 1.196 -1.724 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.217 174.584 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 575' ' ' ASN . . . . . 0.461 ' HB3' HG22 ' A' ' 598' ' ' VAL . 88.3 m-20 -57.14 -48.87 77.62 Favored 'General case' 0 C--O 1.244 0.787 0 O-C-N 123.675 0.609 . . . . 0.0 110.319 -178.667 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 11.4 t60 -64.53 -47.17 79.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.551 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -66.47 -40.51 89.39 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.57 -49.13 78.58 Favored 'General case' 0 CA--C 1.501 -0.913 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.704 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 579' ' ' ARG . . . . . 0.436 ' HA ' ' HD2' ' A' ' 591' ' ' LYS . 0.0 OUTLIER -58.89 -42.61 89.96 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 124.203 0.939 . . . . 0.0 110.051 179.733 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -69.96 -41.92 73.85 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 116.277 -0.42 . . . . 0.0 112.032 -176.192 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -60.2 -50.5 73.42 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.521 0.676 . . . . 0.0 111.522 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 582' ' ' THR . . . . . 0.533 ' HB ' ' HB3' ' A' ' 586' ' ' ASP . 22.6 p -72.89 -24.83 60.89 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -176.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 583' ' ' ARG . . . . . . . . . . . . . 53.7 ttt180 -44.01 -9.16 0.01 OUTLIER 'General case' 0 CA--C 1.577 1.993 0 C-N-CA 126.496 1.919 . . . . 0.0 115.269 -178.979 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 37.8 pt -77.03 10.3 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.308 0 C-N-CA 123.833 0.853 . . . . 0.0 112.724 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 126.82 14.2 2.86 Favored Glycine 0 N--CA 1.469 0.878 0 C-N-CA 120.35 -0.928 . . . . 0.0 113.673 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 586' ' ' ASP . . . . . 0.533 ' HB3' ' HB ' ' A' ' 582' ' ' THR . 34.8 t70 -82.59 167.93 17.82 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 124.259 1.024 . . . . 0.0 111.971 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.6 p -41.91 21.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.594 2.652 1 C-N-CA 131.933 4.093 . . . . 0.0 115.74 177.575 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.473 ' H ' ' C ' ' A' ' 586' ' ' ASP . 43.0 mm-40 -43.52 -8.34 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 129.06 2.944 . . . . 0.0 116.398 -175.123 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 589' ' ' LEU . . . . . 0.425 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 60.2 mt -69.67 -56.55 6.94 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 167.157 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 55.5 tp60 -53.73 -42.44 68.12 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.433 172.281 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.473 ' HG3' HD22 ' A' ' 594' ' ' LEU . 2.2 ttmp? -80.78 -15.75 55.61 Favored 'General case' 0 C--O 1.197 -1.665 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.606 -178.536 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 592' ' ' TYR . . . . . 0.425 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 72.7 t80 -59.82 -39.87 86.54 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 173.299 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -56.16 -46.81 79.17 Favored 'General case' 0 CA--C 1.562 1.419 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.696 174.247 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.473 HD22 ' HG3' ' A' ' 591' ' ' LYS . 9.2 mp -63.75 -33.45 75.69 Favored 'General case' 0 C--O 1.212 -0.879 0 CA-C-O 121.227 0.537 . . . . 0.0 111.107 174.623 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 595' ' ' GLN . . . . . 0.494 ' HA ' HG23 ' A' ' 598' ' ' VAL . 14.6 tt0 -65.96 -27.53 68.23 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 123.289 0.636 . . . . 0.0 110.557 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -68.21 -41.58 81.1 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 171.626 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 54.4 mt -59.33 -34.2 53.38 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.738 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.921 173.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 598' ' ' VAL . . . . . 0.494 HG23 ' HA ' ' A' ' 595' ' ' GLN . 57.8 t -62.24 -36.74 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 174.492 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.509 ' O ' ' HB3' ' A' ' 602' ' ' LYS . . . -63.44 -33.5 75.69 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.263 177.248 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -67.18 -38.71 85.84 Favored 'General case' 0 C--O 1.251 1.134 0 CA-C-O 121.633 0.73 . . . . 0.0 109.093 174.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 5.7 t30 -62.12 -33.38 74.35 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.593 174.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 602' ' ' LYS . . . . . 0.509 ' HB3' ' O ' ' A' ' 599' ' ' ALA . 19.4 ttpt -65.13 -46.33 81.41 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.553 173.597 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 603' ' ' GLU . . . . . 0.485 ' HG3' ' HE3' ' A' ' 602' ' ' LYS . 44.9 mt-10 -74.07 -1.92 22.17 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -176.37 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 604' ' ' ARG . . . . . 0.469 ' HD2' ' OE1' ' A' ' 572' ' ' GLU . 47.5 mtp180 -67.82 19.93 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 123.653 0.781 . . . . 0.0 112.156 171.003 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 605' ' ' MET . . . . . 0.457 ' H ' ' C ' ' A' ' 603' ' ' GLU . 56.1 ttp . . . . . 0 C--N 1.296 -1.754 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 -179.483 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 N--CA 1.434 -1.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -130.65 79.55 1.9 Allowed 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 177.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -124.65 46.04 2.4 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.403 -177.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 92.2 mt -73.07 103.32 3.79 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.916 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 39.7 m -101.76 127.86 48.35 Favored 'General case' 0 C--N 1.278 -2.502 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 468' ' ' ARG . . . . . 0.524 ' HB2' HG13 ' A' ' 562' ' ' VAL . 88.4 mtm180 -62.74 -12.77 26.11 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -177.77 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 469' ' ' GLN . . . . . 0.461 ' O ' ' HG3' ' A' ' 473' ' ' GLU . 24.6 mt-30 -40.99 -49.55 3.29 Favored 'General case' 0 C--O 1.206 -1.185 0 C-N-CA 125.479 1.511 . . . . 0.0 114.156 -177.789 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -68.74 -31.81 71.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.953 0.406 . . . . 0.0 111.039 -174.803 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 22.8 tptp -74.76 -29.81 61.26 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 472' ' ' ALA . . . . . 0.537 ' HB2' HG11 ' A' ' 562' ' ' VAL . . . -69.82 -47.92 60.97 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 174.417 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 473' ' ' GLU . . . . . 0.483 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 57.7 mt-10 -49.81 -49.57 48.32 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.64 0.776 . . . . 0.0 109.488 173.687 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 474' ' ' ARG . . . . . 0.55 ' HG3' ' CD2' ' A' ' 542' ' ' LEU . 11.1 tpp85 -46.79 -60.89 2.12 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 125.261 1.424 . . . . 0.0 109.657 -178.277 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 475' ' ' ALA . . . . . 0.533 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -68.53 -36.01 78.26 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-N 115.289 -0.868 . . . . 0.0 112.445 -177.132 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -33.54 74.69 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.332 0.586 . . . . 0.0 112.079 -177.218 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 477' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 94.0 mt -73.47 -8.84 57.57 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -176.775 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 478' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 63.3 pttt -76.5 6.38 5.86 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.917 -0.49 . . . . 0.0 110.993 -178.133 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 10.4 t-80 -77.75 23.94 0.23 Allowed 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 123.741 0.816 . . . . 0.0 112.729 -172.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 480' ' ' LEU . . . . . 0.4 HD12 ' H ' ' A' ' 482' ' ' ARG 0.29 2.7 pp 49.76 -158.8 0.07 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.629 1.572 . . . . 0.0 114.798 177.165 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 481' ' ' MET . . . . . 0.469 ' C ' ' H ' ' A' ' 483' ' ' ASP . 46.9 ttm -66.7 6.95 0.41 Allowed 'General case' 0 CA--C 1.569 1.695 0 CA-C-O 122.569 1.175 . . . . 0.0 113.648 -174.659 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 482' ' ' ARG . . . . . 0.4 ' H ' HD12 ' A' ' 480' ' ' LEU . 26.7 mmt180 -74.69 11.1 1.12 Allowed 'General case' 0 C--O 1.248 0.998 0 C-N-CA 123.899 0.88 . . . . 0.0 110.153 167.102 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 483' ' ' ASP . . . . . 0.469 ' H ' ' C ' ' A' ' 481' ' ' MET . 9.5 p-10 -68.81 1.0 3.65 Favored 'General case' 0 C--O 1.201 -1.478 0 C-N-CA 126.231 1.812 . . . . 0.0 113.608 -169.304 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -72.28 -60.37 2.26 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.54 -53.52 56.59 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.544 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 86.1 m -59.44 -37.97 79.49 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.786 -178.716 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 487' ' ' PHE . . . . . 0.415 ' HB2' ' O ' ' A' ' 483' ' ' ASP . 46.7 t80 -56.15 -58.02 9.73 Favored 'General case' 0 C--O 1.205 -1.269 0 C-N-CA 120.419 -0.513 . . . . 0.0 110.158 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 5.9 mp -72.29 -31.91 66.13 Favored 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 119.454 -0.898 . . . . 0.0 111.364 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -68.26 -41.06 81.67 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.932 0.396 . . . . 0.0 111.32 -177.196 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -85.28 -35.41 21.53 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.546 -178.685 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -58.26 -46.36 86.15 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 122.873 0.469 . . . . 0.0 112.259 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -81.65 -15.58 54.12 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -177.118 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 73.4 m -80.98 -28.42 35.56 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -178.293 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 11.8 t -98.52 152.3 4.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -152.23 -39.58 0.11 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.693 0.759 . . . . 0.0 110.27 -178.134 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -82.44 18.7 1.4 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.938 178.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 497' ' ' ASP . . . . . 0.742 ' O ' ' HB3' ' A' ' 501' ' ' ASN . 7.6 p-10 -65.93 -19.51 65.89 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 123.837 0.855 . . . . 0.0 110.78 -178.99 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 498' ' ' ASN . . . . . 0.437 ' HA ' ' ND2' ' A' ' 501' ' ' ASN . 6.9 t-20 -72.88 15.45 0.2 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.751 1.22 . . . . 0.0 114.023 -165.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -75.65 -71.95 0.34 Allowed 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 26.0 m -127.36 93.36 3.71 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 170.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 501' ' ' ASN . . . . . 0.742 ' HB3' ' O ' ' A' ' 497' ' ' ASP . 34.8 p-10 -127.14 46.33 2.54 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -169.127 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 18.3 pm0 -73.17 -25.29 60.74 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.319 -0.952 . . . . 0.0 108.485 173.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 503' ' ' HIS . . . . . 0.436 ' O ' HG23 ' A' ' 507' ' ' VAL . 38.3 t-80 -62.64 -64.49 0.9 Allowed 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.218 175.888 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -55.74 -38.48 69.85 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 124.025 0.93 . . . . 0.0 110.639 -179.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -64.88 -52.02 58.82 Favored 'General case' 0 CA--C 1.5 -0.943 0 C-N-CA 123.079 0.552 . . . . 0.0 109.595 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -62.61 -41.67 99.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 507' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 503' ' ' HIS . 67.0 t -62.36 -52.96 53.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.714 178.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -49.64 -53.06 26.41 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 124.534 1.146 . . . . 0.0 111.838 176.031 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -56.79 -62.63 1.6 Allowed 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.321 0.648 . . . . 0.0 112.185 -177.312 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 48.6 t -59.69 -45.85 93.98 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.665 0 O-C-N 123.692 0.62 . . . . 0.0 110.944 -176.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 3.2 tt -69.23 -49.08 59.66 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.955 -172.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -67.76 -29.52 68.75 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.185 -176.228 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -64.43 -49.23 72.33 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.244 0.545 . . . . 0.0 110.434 178.707 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -70.48 -55.25 9.4 Favored 'General case' 0 C--O 1.198 -1.627 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.232 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -52.67 -36.32 56.74 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -178.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -77.6 -19.38 55.67 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.34 -45.6 2.92 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 122.111 0.958 . . . . 0.0 110.018 -172.792 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 39.0 t-20 -112.38 -154.34 0.54 Allowed 'General case' 0 C--N 1.286 -2.169 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 519' ' ' ASP . . . . . 0.406 ' HB3' ' H ' ' A' ' 520' ' ' GLN . 9.1 m-20 -83.82 -160.24 0.43 Allowed 'General case' 0 C--N 1.308 -1.221 0 C-N-CA 123.468 0.707 . . . . 0.0 109.878 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 520' ' ' GLN . . . . . 0.425 ' HB3' ' OD1' ' A' ' 483' ' ' ASP . 15.5 mp0 -62.62 177.12 0.56 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.617 0.767 . . . . 0.0 110.257 178.265 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -88.11 148.81 24.27 Favored 'General case' 1 N--CA 1.37 -4.449 0 O-C-N 121.543 -0.723 . . . . 0.0 109.638 -175.242 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 522' ' ' ASN . . . . . 0.493 ' HB3' ' OD2' ' A' ' 525' ' ' ASP . 52.0 t30 -116.11 154.64 29.6 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.466 0.65 . . . . 0.0 111.313 -174.634 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -37.21 78.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 C-N-CA 124.776 1.23 . . . . 0.0 110.7 -178.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 39.0 t -57.1 -33.01 66.88 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.956 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 525' ' ' ASP . . . . . 0.493 ' OD2' ' HB3' ' A' ' 522' ' ' ASN . 12.0 m-20 -61.1 -40.69 94.7 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.303 0.573 . . . . 0.0 110.0 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 526' ' ' ALA . . . . . 0.47 ' HA ' ' HD3' ' A' ' 536' ' ' ARG . . . -63.57 -43.17 97.79 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.243 178.019 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 527' ' ' VAL . . . . . 0.495 ' O ' HG22 ' A' ' 530' ' ' VAL . 96.9 t -64.63 -35.34 74.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 C-N-CA 125.033 1.333 . . . . 0.0 110.805 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 98.5 mt-30 -66.74 -34.63 78.26 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.43 0.634 . . . . 0.0 109.595 175.4 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.605 ' HB3' ' HD2' ' A' ' 536' ' ' ARG . 1.1 t80 -77.28 2.62 15.11 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 -178.735 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 530' ' ' VAL . . . . . 0.495 HG22 ' O ' ' A' ' 527' ' ' VAL . 14.7 m -74.69 15.0 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -176.174 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -109.03 -36.22 6.13 Favored 'General case' 0 C--N 1.285 -2.228 0 C-N-CA 119.458 -0.897 . . . . 0.0 108.644 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 532' ' ' SER . . . . . 0.495 ' C ' ' H ' ' A' ' 534' ' ' GLU . 26.3 t -81.44 -143.16 0.05 OUTLIER 'General case' 0 C--N 1.29 -2.019 0 C-N-CA 125.63 1.572 . . . . 0.0 107.673 173.234 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 533' ' ' ASN . . . . . 0.463 ' C ' ' H ' ' A' ' 535' ' ' LEU 0.386 17.2 m120 -35.14 29.08 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.986 1 C-N-CA 132.926 4.49 . . . . 0.0 118.764 171.607 . . . . . . . . 4 3 . 1 . 020 nuclear build full ' A' A ' 534' ' ' GLU . . . . . 0.495 ' H ' ' C ' ' A' ' 532' ' ' SER . 9.6 pt-20 -34.63 8.04 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 130.515 3.526 . . . . 0.0 116.008 177.656 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 535' ' ' LEU . . . . . 0.463 ' H ' ' C ' ' A' ' 533' ' ' ASN . 3.3 pp -67.77 -21.36 65.26 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 162.179 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 536' ' ' ARG . . . . . 0.605 ' HD2' ' HB3' ' A' ' 529' ' ' TYR . 28.0 ttm-85 -66.56 -24.86 66.42 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.676 -1.602 . . . . 0.0 110.445 171.191 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 537' ' ' GLU . . . . . 0.45 ' HA ' HD12 ' A' ' 540' ' ' ILE . 2.4 tm-20 -75.34 -39.2 59.63 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.803 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 538' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 541' ' ' SER . 8.9 m -57.7 -42.23 83.29 Favored 'General case' 0 CA--C 1.563 1.48 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.45 173.61 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.07 -43.09 91.71 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.031 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 540' ' ' ILE . . . . . 0.566 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 75.2 mt -57.29 -40.51 74.35 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.256 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 541' ' ' SER . . . . . 0.414 ' HB2' ' O ' ' A' ' 538' ' ' THR . 26.4 m -56.31 -38.79 71.75 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 120.934 0.397 . . . . 0.0 111.339 177.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 542' ' ' LEU . . . . . 0.615 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 8.3 mp -69.59 -24.8 63.73 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 120.801 0.334 . . . . 0.0 111.644 174.393 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -75.44 -38.64 59.6 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 544' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 540' ' ' ILE . 74.7 mm-40 -79.5 33.63 0.25 Allowed 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 125.763 1.625 . . . . 0.0 110.481 177.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 545' ' ' TYR . . . . . 0.615 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 8.6 p90 -65.12 154.49 37.76 Favored 'General case' 0 N--CA 1.404 -2.77 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -169.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -83.6 -176.19 6.18 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.497 -1.228 . . . . 0.0 109.017 -174.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 547' ' ' LEU . . . . . 0.421 ' C ' ' H ' ' A' ' 549' ' ' ASP . 2.2 pp -69.45 17.54 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -174.927 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -73.96 22.43 0.09 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.251 1.821 . . . . 0.0 111.782 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 549' ' ' ASP . . . . . 0.421 ' H ' ' C ' ' A' ' 547' ' ' LEU . 28.5 t70 -72.12 -6.79 45.05 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 124.008 0.923 . . . . 0.0 112.19 -177.588 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 550' ' ' GLU . . . . . 0.409 ' HB2' ' HD2' ' A' ' 551' ' ' PRO . 1.0 OUTLIER -59.43 158.91 18.6 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-O 119.313 -0.375 . . . . 0.0 110.266 -177.629 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 551' ' ' PRO . . . . . 0.409 ' HD2' ' HB2' ' A' ' 550' ' ' GLU . 20.0 Cg_endo -59.7 72.99 0.06 OUTLIER 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 122.86 2.373 . . . . 0.0 115.105 -179.088 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -100.67 9.7 42.11 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 173.658 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.35 14.2 0.1 Allowed 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 113.408 -1.724 . . . . 0.0 113.934 -174.47 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 554' ' ' ASN . . . . . 0.546 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 3.9 t30 -68.5 -19.98 64.56 Favored 'General case' 0 C--O 1.192 -1.953 0 N-CA-C 104.12 -2.548 . . . . 0.0 104.12 165.729 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -33.46 -42.06 0.09 Allowed 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 127.528 2.331 . . . . 0.0 111.783 168.587 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 556' ' ' ILE . . . . . 0.425 HG22 ' HD3' ' A' ' 577' ' ' LYS . 21.9 mm -62.02 -44.3 98.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 109.425 -0.584 . . . . 0.0 109.425 177.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 557' ' ' ASP . . . . . 0.546 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 6.4 t70 -58.64 -44.11 89.96 Favored 'General case' 0 C--O 1.25 1.112 0 C-N-CA 124.261 1.024 . . . . 0.0 110.443 176.625 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -68.91 -49.21 60.08 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.325 177.309 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 559' ' ' TYR . . . . . 0.471 ' CD1' ' HB1' ' A' ' 472' ' ' ALA . 48.4 t80 -50.25 -52.06 39.38 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.164 1.386 . . . . 0.0 111.356 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 560' ' ' VAL . . . . . 0.418 HG21 ' CD ' ' A' ' 577' ' ' LYS . 48.4 t -62.96 -39.18 84.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.213 -179.326 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -61.45 -36.5 80.58 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-O 120.705 0.288 . . . . 0.0 110.514 175.046 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 562' ' ' VAL . . . . . 0.537 HG11 ' HB2' ' A' ' 472' ' ' ALA . 54.0 t -70.63 -33.75 54.3 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.05 0 C-N-CA 123.863 0.865 . . . . 0.0 112.905 177.692 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 563' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 559' ' ' TYR . 49.1 mm -84.17 -40.1 15.25 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.717 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 -176.965 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -79.39 -2.97 44.17 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 114.449 -1.25 . . . . 0.0 110.164 178.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 565' ' ' GLU . . . . . 0.522 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 19.1 tt0 -56.55 -35.08 67.73 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 170.201 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 19.9 mmtp -117.44 20.36 13.61 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 113.927 -1.488 . . . . 0.0 109.885 179.065 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -102.75 -121.17 4.87 Favored Glycine 0 N--CA 1.432 -1.61 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.674 -176.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -145.8 -92.01 0.09 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -176.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -65.14 117.33 7.58 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 123.425 0.69 . . . . 0.0 110.968 -173.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 570' ' ' THR . . . . . 0.626 ' O ' ' HG ' ' A' ' 574' ' ' LEU . 88.1 m -104.56 -77.41 0.58 Allowed 'General case' 0 N--CA 1.423 -1.803 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -171.873 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.3 tt -53.14 -51.36 39.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 -163.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -79.44 -26.62 41.76 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.727 -0.789 . . . . 0.0 111.583 -175.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 20.9 m -65.82 -35.66 81.31 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 176.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 574' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 570' ' ' THR . 60.9 mt -61.18 -51.9 67.09 Favored 'General case' 0 C--O 1.208 -1.118 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.124 175.087 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -58.36 -41.21 84.21 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 120.931 0.396 . . . . 0.0 111.985 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -61.15 -47.74 84.85 Favored 'General case' 0 C--O 1.249 1.067 0 CA-C-O 121.631 0.729 . . . . 0.0 109.995 175.968 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 577' ' ' LYS . . . . . 0.584 ' HA ' ' HE3' ' A' ' 577' ' ' LYS . 0.7 OUTLIER -67.54 -42.71 82.28 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.066 -177.749 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 578' ' ' LEU . . . . . 0.432 ' HG ' HD21 ' A' ' 594' ' ' LEU . 54.4 tp -55.41 -48.12 74.87 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 123.943 0.897 . . . . 0.0 111.797 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 579' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -62.66 -39.64 94.55 Favored 'General case' 0 C--O 1.251 1.177 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.926 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 580' ' ' GLU . . . . . 0.691 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 31.9 tt0 -68.63 -33.59 74.28 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 121.007 0.432 . . . . 0.0 109.951 177.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 581' ' ' ALA . . . . . 0.489 ' O ' HG12 ' A' ' 584' ' ' ILE . . . -61.29 -48.91 79.22 Favored 'General case' 0 C--O 1.183 -2.433 0 C-N-CA 122.568 0.347 . . . . 0.0 110.319 174.573 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 582' ' ' THR . . . . . . . . . . . . . 32.7 p -60.63 -24.89 65.88 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 583' ' ' ARG . . . . . 0.691 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 60.0 ttt180 -53.87 -6.39 0.09 Allowed 'General case' 0 CA--C 1.601 2.927 0 C-N-CA 123.896 0.878 . . . . 0.0 112.275 169.361 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 584' ' ' ILE . . . . . 0.489 HG12 ' O ' ' A' ' 581' ' ' ALA . 31.8 pt -72.05 41.23 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.401 0 C-N-CA 124.524 1.13 . . . . 0.0 113.399 177.615 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 131.04 -55.45 0.77 Allowed Glycine 0 C--N 1.281 -2.501 0 CA-C-O 119.035 -0.87 . . . . 0.0 114.831 169.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -87.67 75.44 9.01 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 119.42 1.61 . . . . 0.0 109.204 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 587' ' ' VAL . . . . . 0.549 ' O ' ' HB3' ' A' ' 591' ' ' LYS . 59.6 t -64.69 -67.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.164 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.532 -177.771 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 588' ' ' GLU . . . . . 0.499 ' O ' ' HB2' ' A' ' 592' ' ' TYR . 0.0 OUTLIER -61.55 -47.55 85.03 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -177.368 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 9.9 tt -70.39 -66.13 0.64 Allowed 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -174.689 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -60.91 -42.48 98.15 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -175.139 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 591' ' ' LYS . . . . . 0.549 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 58.7 tttm -65.7 -37.13 85.59 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-O 119.62 -0.229 . . . . 0.0 110.864 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 592' ' ' TYR . . . . . 0.499 ' HB2' ' O ' ' A' ' 588' ' ' GLU . 58.1 t80 -57.02 -51.67 68.33 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.464 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 593' ' ' TYR . . . . . 0.492 ' O ' HG13 ' A' ' 597' ' ' ILE . 56.2 m-85 -62.74 -59.97 4.15 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.563 178.459 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 594' ' ' LEU . . . . . 0.432 HD21 ' HG ' ' A' ' 578' ' ' LEU . 40.8 tp -55.69 -53.23 59.18 Favored 'General case' 0 CA--C 1.497 -1.093 0 O-C-N 123.703 0.627 . . . . 0.0 112.104 -172.568 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -65.07 -36.69 85.12 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.081 -175.386 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -63.29 -46.43 86.81 Favored 'General case' 0 C--O 1.242 0.706 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.404 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 597' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 593' ' ' TYR . 80.4 mt -57.66 -57.99 8.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.477 176.071 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 94.7 t -62.0 -41.72 92.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.637 -175.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 599' ' ' ALA . . . . . 0.433 ' O ' ' HG2' ' A' ' 603' ' ' GLU . . . -59.74 -46.11 90.15 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 120.886 0.374 . . . . 0.0 110.004 178.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -64.45 -46.34 83.57 Favored 'General case' 0 C--O 1.211 -0.963 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.563 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -62.54 -34.68 77.4 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 123.82 0.848 . . . . 0.0 111.727 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 602' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -65.71 -54.9 21.07 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.399 -179.166 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 603' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 599' ' ' ALA . 12.0 pt-20 -75.61 -17.06 60.14 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.84 -177.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -69.4 -40.53 77.28 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 28.4 ttt . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 124.749 1.22 . . . . 0.0 109.779 -176.582 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 89.0 mt . . . . . 0 N--CA 1.437 -1.091 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . 0.446 ' HB3' ' OE1' ' A' ' 470' ' ' GLU . 33.0 t -85.46 174.66 9.34 Favored 'General case' 0 C--N 1.272 -2.795 0 CA-C-N 114.461 -1.245 . . . . 0.0 111.889 -171.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 10.0 ptm85 -65.5 -22.86 66.77 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.611 -1.631 . . . . 0.0 110.744 176.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.496 HE21 HG23 ' A' ' 563' ' ' ILE . 51.0 mt-30 -67.27 -34.35 77.24 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 177.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.446 ' OE1' ' HB3' ' A' ' 467' ' ' SER . 2.3 mp0 -73.86 -23.2 59.58 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.509 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.02 -33.38 70.3 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 106.168 -1.79 . . . . 0.0 106.168 174.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 469' ' ' GLN . . . -67.25 -42.29 84.16 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.492 174.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.7 -60.62 2.96 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 122.37 1.081 . . . . 0.0 109.257 172.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 55.2 mtt180 -52.83 -46.34 67.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 113.66 -1.609 . . . . 0.0 112.466 -178.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -70.89 -36.82 72.92 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -62.95 -29.84 71.11 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 121.577 0.703 . . . . 0.0 110.57 -178.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 91.5 mt -73.23 -7.33 51.0 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.968 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 542' ' ' LEU . 37.8 ttmt -77.17 -13.67 59.91 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 176.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 54.8 t60 -60.66 137.74 58.15 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 63.2 mt -51.52 123.35 9.67 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-O 122.126 0.965 . . . . 0.0 112.573 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 52.4 mtt -71.74 1.26 7.12 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.286 -1.779 . . . . 0.0 113.502 -170.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -68.08 -44.65 75.82 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 171.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -74.7 58.78 0.82 Allowed 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 126.485 1.914 . . . . 0.0 111.879 -174.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . 0.634 ' HE3' HD23 ' A' ' 511' ' ' LEU . 12.5 mmmm -62.14 -18.01 59.59 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.965 -1.016 . . . . 0.0 113.346 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -57.46 -39.85 77.23 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 171.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 19.8 m -60.17 -35.01 74.39 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.843 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . 0.465 ' CE1' ' HA ' ' A' ' 508' ' ' PHE . 4.9 t80 -58.62 -51.98 67.61 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-O 121.122 0.487 . . . . 0.0 110.078 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 53.9 tp -70.57 -31.48 68.53 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.809 -176.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -69.5 -42.11 75.2 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.007 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.66 -31.43 57.31 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -178.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . 0.41 ' O ' HG12 ' A' ' 494' ' ' VAL . 6.3 t80 -60.39 -51.1 70.91 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.45 176.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -85.29 -12.11 53.14 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 45.8 m -87.41 -15.16 38.57 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.634 0.731 . . . . 0.0 109.527 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . 0.41 HG12 ' O ' ' A' ' 491' ' ' TYR . 1.4 p -99.45 176.52 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.415 -2.216 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.01 -175.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -85.01 100.71 11.85 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.469 0.652 . . . . 0.0 111.811 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -65.5 -30.46 71.23 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.486 178.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.8 -72.04 0.21 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.67 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -92.12 -33.43 14.76 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -78.64 -7.59 57.79 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.956 -171.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.3 t -60.73 108.33 0.83 Allowed 'General case' 0 CA--C 1.563 1.445 0 CA-C-O 123.299 1.523 . . . . 0.0 111.235 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.425 ' ND2' ' HG2' ' A' ' 470' ' ' GLU . 54.2 t-20 -93.94 157.65 16.01 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 113.56 -1.655 . . . . 0.0 107.679 -178.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -62.84 -34.04 76.51 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 122.032 0.92 . . . . 0.0 108.821 174.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -60.18 -51.02 71.35 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.683 -1.144 . . . . 0.0 108.76 174.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -60.7 -37.64 82.35 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.859 178.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -63.65 -51.69 64.07 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . . . . . . . . 0.256 25.8 m-85 -62.84 -42.3 99.68 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 177.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . 0.492 ' O ' HD13 ' A' ' 511' ' ' LEU . 92.5 t -63.51 -56.7 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.945 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . 0.465 ' HA ' ' CE1' ' A' ' 487' ' ' PHE . 13.6 t80 -49.27 -48.65 45.81 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 177.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -61.73 -55.9 25.35 Favored 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 123.185 0.594 . . . . 0.0 111.821 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 42.9 t -61.62 -45.71 98.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.688 0.756 . . . . 0.0 110.717 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.634 HD23 ' HE3' ' A' ' 484' ' ' LYS . 10.3 mp -67.67 -31.57 71.63 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.406 -175.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 13.9 t60 -72.31 -32.86 66.92 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.013 176.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.0 -40.81 98.89 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.371 0.605 . . . . 0.0 110.231 -179.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -76.3 -36.64 58.26 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.949 176.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . 0.6 ' HA ' ' HB2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -53.25 -34.04 55.56 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.269 1.027 . . . . 0.0 110.223 177.595 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.59 -18.85 62.2 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.281 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -134.13 -57.76 0.85 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 117.686 -1.606 . . . . 0.0 113.772 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -152.03 107.02 3.25 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 106.028 -1.841 . . . . 0.0 106.028 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . 0.6 ' HB2' ' HA ' ' A' ' 515' ' ' TYR . 28.8 t0 -107.56 96.16 6.2 Favored 'General case' 0 C--N 1.284 -2.267 0 N-CA-C 117.718 2.488 . . . . 0.0 117.718 -163.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -141.96 126.3 17.63 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 113.984 -1.462 . . . . 0.0 107.722 162.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -100.63 132.9 45.78 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -120.19 172.3 7.88 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . 0.523 HG13 HD12 ' A' ' 540' ' ' ILE . 0.9 OUTLIER -52.05 -46.29 42.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 C-N-CA 126.803 2.041 . . . . 0.0 109.877 171.299 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.408 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 2.9 m -51.75 -37.22 50.23 Favored 'General case' 0 N--CA 1.428 -1.533 0 C-N-CA 125.508 1.523 . . . . 0.0 111.627 -176.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -65.23 -50.8 64.46 Favored 'General case' 0 C--O 1.248 0.992 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.799 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.536 ' HB3' HD11 ' A' ' 540' ' ' ILE . . . -65.98 -28.95 69.28 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.384 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.527 ' HA ' HG13 ' A' ' 530' ' ' VAL . 42.7 t -67.97 -35.36 71.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 C-N-CA 125.321 1.448 . . . . 0.0 110.997 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 524' ' ' SER . 98.8 mt-30 -65.9 -30.5 71.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 174.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.549 ' HB3' ' HG2' ' A' ' 536' ' ' ARG . 31.5 m-85 -76.5 9.42 2.71 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 175.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.617 ' HA ' ' CZ ' ' A' ' 536' ' ' ARG . 34.4 m -72.7 12.49 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.637 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 -176.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -108.46 -43.66 4.27 Favored 'General case' 0 C--N 1.276 -2.597 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 170.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 6.5 m -75.51 -144.07 0.02 OUTLIER 'General case' 0 C--N 1.289 -2.05 0 C-N-CA 127.73 2.412 . . . . 0.0 112.512 -178.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . 0.461 ' O ' ' N ' ' A' ' 535' ' ' LEU . 16.8 m120 -26.64 30.94 0.0 OUTLIER 'General case' 0 CA--C 1.469 -2.14 1 C-N-CA 138.99 6.916 . . . . 0.0 118.402 179.017 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . 0.534 ' HA ' ' NE ' ' A' ' 536' ' ' ARG . 9.0 pt-20 -30.07 -5.91 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.752 0 C-N-CA 130.769 3.628 . . . . 0.0 116.904 -175.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.57 HD13 ' H ' ' A' ' 535' ' ' LEU . 0.0 OUTLIER -68.55 -12.18 60.94 Favored 'General case' 0 CA--C 1.57 1.745 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 163.86 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.627 ' HD2' ' N ' ' A' ' 537' ' ' GLU . 3.8 ppt_? -66.8 -28.76 68.64 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 126.65 1.98 . . . . 0.0 109.9 169.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . 0.627 ' N ' ' HD2' ' A' ' 536' ' ' ARG . 43.3 tt0 -77.05 -41.0 44.2 Favored 'General case' 0 CA--C 1.479 -1.77 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' A' ' 541' ' ' SER . 18.5 m -56.3 -47.73 78.09 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.254 173.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 55.7 tp -57.59 -45.65 85.02 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 122.825 0.45 . . . . 0.0 111.526 176.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . 0.536 HD11 ' HB3' ' A' ' 526' ' ' ALA . 24.8 mm -61.25 -40.45 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 176.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . 0.431 ' HB3' ' O ' ' A' ' 538' ' ' THR . 35.9 t -57.24 -41.59 79.85 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 123.543 0.737 . . . . 0.0 110.033 174.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.405 ' O ' ' HE2' ' A' ' 478' ' ' LYS . 3.8 mm? -63.09 -37.72 88.32 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.164 174.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -68.7 -32.49 72.34 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-O 121.542 0.687 . . . . 0.0 110.441 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.5 tp60 -67.54 -34.95 78.13 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.122 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -70.61 136.41 49.15 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.68 172.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -102.75 141.72 35.08 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -169.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 87.1 mt -82.55 4.4 24.7 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.068 -1.424 . . . . 0.0 109.193 171.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -73.08 -58.07 3.58 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.955 -1.02 . . . . 0.0 108.71 174.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -74.65 -6.06 46.58 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.226 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.436 ' HB3' HD22 ' A' ' 554' ' ' ASN . 41.4 mt-10 -109.22 139.5 21.09 Favored Pre-proline 0 C--N 1.306 -1.287 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.611 177.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . 0.46 ' HD2' ' ND2' ' A' ' 554' ' ' ASN . 16.3 Cg_exo -71.3 152.36 61.14 Favored 'Trans proline' 0 C--O 1.242 0.718 0 N-CA-C 107.166 -1.898 . . . . 0.0 107.166 168.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -76.32 -2.49 31.9 Favored 'General case' 0 CA--C 1.503 -0.833 0 C-N-CA 118.669 -1.212 . . . . 0.0 112.794 -176.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . 0.69 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 44.2 mp0 -74.96 -13.48 60.52 Favored 'General case' 0 C--N 1.278 -2.505 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.032 173.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . 0.46 ' ND2' ' HD2' ' A' ' 551' ' ' PRO . 92.7 m-20 -69.31 -21.56 63.85 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.458 172.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -78.98 -92.74 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.552 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 28.5 pt -58.89 -45.5 91.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -174.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . 0.69 ' HB3' ' O ' ' A' ' 553' ' ' GLU . 3.4 t70 -60.27 -60.75 3.32 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 117.783 0.265 . . . . 0.0 110.509 -178.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.02 -41.77 98.45 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.976 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -54.69 -52.77 61.36 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 124.251 1.02 . . . . 0.0 111.026 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.07 -46.67 90.62 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.518 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -55.33 -46.42 76.36 Favored 'General case' 0 C--O 1.204 -1.296 0 C-N-CA 123.494 0.717 . . . . 0.0 112.503 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . 0.543 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 53.1 t -66.62 -40.42 86.2 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.123 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.496 HG23 HE21 ' A' ' 469' ' ' GLN . 54.1 mt -83.37 -32.78 9.44 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.298 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.75 -174.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -89.88 -8.24 52.35 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.941 -176.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 12.4 pt-20 -76.72 -20.06 56.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 177.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? . . . . . 0 CA--C 1.562 1.416 0 CA-C-N 113.988 -1.46 . . . . 0.0 109.062 179.794 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.5 pp . . . . . 0 C--O 1.241 0.615 0 N-CA-C 116.137 1.903 . . . . 0.0 116.137 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . 0.441 ' O ' ' HG2' ' A' ' 470' ' ' GLU . 28.8 m -89.14 137.13 32.6 Favored 'General case' 0 N--CA 1.42 -1.959 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.711 -178.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . 0.478 HH21 ' CD ' ' A' ' 565' ' ' GLU . 20.1 ptt180 -60.09 -23.06 63.5 Favored 'General case' 0 C--O 1.26 1.643 0 CA-C-O 122.103 0.954 . . . . 0.0 111.001 176.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.456 ' OE1' ' HD2' ' A' ' 566' ' ' LYS . 0.0 OUTLIER -57.03 -38.17 72.78 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.837 177.361 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.635 ' O ' ' HG2' ' A' ' 474' ' ' ARG . 9.1 pt-20 -71.22 -21.9 62.07 Favored 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 119.281 -0.968 . . . . 0.0 111.699 -174.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -73.1 -39.99 65.35 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -60.75 -40.45 92.5 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.091 175.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . 0.429 ' HG2' ' HA ' ' A' ' 470' ' ' GLU . 49.0 mm-40 -61.16 -35.71 77.86 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.79 176.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.635 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 21.0 mmt85 -58.63 -42.26 87.87 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -71.46 -47.42 55.82 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.581 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -58.43 -34.15 70.48 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 122.231 1.015 . . . . 0.0 110.794 -178.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.501 HD21 HG11 ' A' ' 507' ' ' VAL . 23.7 tp -61.49 -10.62 8.17 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 125.987 1.715 . . . . 0.0 111.776 178.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.584 ' HD2' ' O ' ' A' ' 542' ' ' LEU . 9.0 mmpt? -82.57 -12.17 57.91 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 44.6 m170 -70.96 138.71 50.24 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.861 177.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 95.1 mt -65.62 137.99 57.71 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 121.478 0.656 . . . . 0.0 111.377 -175.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . 0.497 ' C ' ' HG3' ' A' ' 520' ' ' GLN . 0.9 OUTLIER -67.13 3.28 1.2 Allowed 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.449 -1.251 . . . . 0.0 114.305 -174.235 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . 0.454 ' N ' ' HG3' ' A' ' 520' ' ' GLN . 18.8 tpt180 -66.8 -35.17 79.45 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 172.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -77.5 59.71 1.96 Allowed 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.363 172.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -44.13 -30.3 0.74 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.138 1.375 . . . . 0.0 111.999 177.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -56.73 -58.57 7.51 Favored 'General case' 0 C--O 1.197 -1.663 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.699 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 98.8 m -53.19 -39.35 63.58 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.323 0.649 . . . . 0.0 112.002 -178.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . 0.423 ' CE1' ' HB3' ' A' ' 511' ' ' LEU . 41.6 t80 -54.87 -59.48 4.68 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 121.106 0.479 . . . . 0.0 109.985 177.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 99.6 mt -81.64 -19.22 42.22 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 120.131 -0.628 . . . . 0.0 112.477 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -70.97 -39.09 72.73 Favored 'General case' 0 CA--C 1.5 -0.97 0 C-N-CA 122.702 0.401 . . . . 0.0 110.23 177.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -34.15 53.41 Favored 'General case' 0 N--CA 1.425 -1.679 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -178.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -66.36 -24.02 66.43 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 120.188 -0.605 . . . . 0.0 112.457 172.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -88.75 -27.26 21.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 121.029 0.443 . . . . 0.0 111.728 176.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 50.1 m -75.94 -31.02 58.89 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 121.823 -0.548 . . . . 0.0 110.911 -178.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 34.3 t -106.89 155.54 7.55 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 177.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -93.24 134.75 35.12 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 119.038 -1.065 . . . . 0.0 108.457 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.46 ' H ' ' HD2' ' A' ' 496' ' ' LYS 0.26 0.1 OUTLIER -89.59 -42.69 11.26 Favored 'General case' 0 C--N 1.285 -2.231 0 N-CA-C 117.55 2.426 . . . . 0.0 117.55 -164.919 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -60.21 -42.64 95.58 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 -165.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -93.81 -22.89 18.39 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 119.135 -1.026 . . . . 0.0 112.099 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -81.79 -26.85 34.05 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.136 0.493 . . . . 0.0 111.37 -174.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 89.5 m -71.81 101.39 2.6 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.553 0.692 . . . . 0.0 111.476 -179.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -78.4 167.86 20.68 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 171.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -58.59 -25.94 63.12 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.357 0.526 . . . . 0.0 110.212 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . 0.655 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 14.8 m80 -57.69 -60.16 4.11 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.76 174.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -61.0 -32.22 71.81 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.055 -0.975 . . . . 0.0 112.004 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -64.37 -46.73 82.11 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 123.332 0.653 . . . . 0.0 110.676 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.655 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.266 13.7 p90 -66.06 -36.83 84.26 Favored 'General case' 0 N--CA 1.437 -1.083 0 C-N-CA 118.255 -1.378 . . . . 0.0 111.862 179.856 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . 0.501 HG11 HD21 ' A' ' 477' ' ' LEU . 12.9 t -66.5 -53.38 36.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.554 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -48.24 -45.94 34.93 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 124.283 0.989 . . . . 0.0 110.51 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -57.42 -53.56 56.78 Favored 'General case' 0 C--O 1.209 -1.069 0 O-C-N 123.848 0.717 . . . . 0.0 111.649 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 506' ' ' TYR . 21.8 t -55.85 -54.7 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 CA-C-O 121.543 0.687 . . . . 0.0 109.729 -178.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.423 ' HB3' ' CE1' ' A' ' 487' ' ' PHE . 7.4 mp -60.88 -53.96 50.9 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.759 -175.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -65.86 -38.03 87.76 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 123.829 0.852 . . . . 0.0 112.304 -177.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -67.52 -40.63 85.08 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 117.469 0.122 . . . . 0.0 111.18 -176.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -71.58 -49.05 44.14 Favored 'General case' 0 C--O 1.204 -1.342 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -50.88 -39.75 54.77 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.291 1.036 . . . . 0.0 110.451 178.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -62.11 -29.71 70.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.982 -0.553 . . . . 0.0 112.186 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -107.31 -40.43 5.39 Favored 'General case' 0 C--N 1.307 -1.257 0 C-N-CA 119.884 -0.726 . . . . 0.0 111.388 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -128.21 -176.92 3.95 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.809 -167.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -76.41 -154.84 0.05 Allowed 'General case' 0 C--N 1.293 -1.885 0 C-N-CA 128.002 2.521 . . . . 0.0 112.001 177.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . 0.497 ' HG3' ' C ' ' A' ' 481' ' ' MET . 6.1 tt0 -58.51 146.97 33.6 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 125.068 1.347 . . . . 0.0 112.111 -166.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -90.87 146.33 24.01 Favored 'General case' 0 N--CA 1.383 -3.785 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -112.98 157.62 21.27 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.062 -176.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.6 pp -72.11 -10.81 14.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.676 0.751 . . . . 0.0 110.601 178.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 19.4 m -58.38 -38.35 77.12 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.203 170.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -65.12 -36.11 83.25 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.032 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -61.57 -48.84 79.13 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.2 177.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.423 ' O ' HG22 ' A' ' 530' ' ' VAL . 10.6 p -68.36 -28.47 40.7 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-O 121.324 0.583 . . . . 0.0 110.961 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -74.51 -12.14 60.4 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.559 -0.713 . . . . 0.0 110.633 173.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -29.28 47.17 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 527' ' ' VAL 0.337 30.1 m -73.93 54.02 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -173.592 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -107.07 -29.06 9.62 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 173.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 13.0 m -90.33 155.48 18.94 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 172.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -69.12 -73.76 0.14 Allowed 'General case' 0 C--O 1.203 -1.359 0 N-CA-C 116.483 2.031 . . . . 0.0 116.483 -172.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -80.19 -64.34 1.21 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -164.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 84.5 mt -57.15 -42.49 81.11 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-O 121.702 0.763 . . . . 0.0 112.46 -168.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -79.55 -29.31 41.32 Favored 'General case' 0 N--CA 1.398 -3.044 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.962 -175.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -70.03 -39.97 75.46 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 174.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.401 ' O ' HD13 ' A' ' 542' ' ' LEU . 40.3 m -54.28 -46.12 72.64 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.892 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 539' ' ' LEU . 0.4 OUTLIER -60.88 -43.67 98.15 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.631 178.836 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . 0.428 HD13 ' HA ' ' A' ' 540' ' ' ILE . 13.8 mm -62.86 -40.71 89.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 CA-C-O 120.836 0.35 . . . . 0.0 110.923 176.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . 0.526 ' HA ' HE21 ' A' ' 544' ' ' GLN . 49.1 m -54.1 -41.42 68.28 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.381 174.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.584 ' O ' ' HD2' ' A' ' 478' ' ' LYS . 10.3 mp -66.79 -49.79 64.72 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.611 172.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -54.39 -46.72 73.16 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 125.423 1.489 . . . . 0.0 111.608 -173.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . 0.526 HE21 ' HA ' ' A' ' 541' ' ' SER . 29.0 pt20 -72.78 12.74 0.46 Allowed 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -176.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -67.03 133.39 49.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 172.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -93.31 92.2 7.58 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.883 -0.727 . . . . 0.0 109.48 -177.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 3.5 pp -81.86 -22.78 36.75 Favored 'General case' 0 C--O 1.205 -1.24 0 CA-C-N 115.428 -0.806 . . . . 0.0 112.077 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -75.61 -12.4 60.2 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.932 0.872 . . . . 0.0 110.292 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -71.7 -36.0 70.42 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.454 -1.248 . . . . 0.0 112.26 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -125.16 143.59 44.74 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-O 119.308 -0.377 . . . . 0.0 110.132 -174.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -36.79 129.17 0.49 Allowed 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 124.084 3.189 . . . . 0.0 113.246 174.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -79.93 -15.35 57.49 Favored 'General case' 0 CA--C 1.491 -1.299 0 CA-C-O 122.331 1.062 . . . . 0.0 110.502 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -78.8 -12.79 60.04 Favored 'General case' 0 N--CA 1.401 -2.924 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.137 175.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -74.09 -36.45 64.28 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 175.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -59.04 -60.13 4.36 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.628 -177.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 31.2 pt -57.74 -34.4 47.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 O-C-N 123.34 0.4 . . . . 0.0 111.935 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -62.77 -56.28 18.98 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.868 0.842 . . . . 0.0 109.234 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . 0.627 ' O ' HG23 ' A' ' 562' ' ' VAL . 27.0 t70 -59.45 -50.37 74.19 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.504 -1.225 . . . . 0.0 109.754 178.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . 0.527 ' O ' HD13 ' A' ' 563' ' ' ILE . 78.0 t80 -50.82 -53.51 31.49 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 125.564 1.546 . . . . 0.0 111.973 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . 0.432 ' O ' ' HB3' ' A' ' 564' ' ' ASN . 14.4 p -59.84 -40.14 81.9 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.51 -178.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -62.62 -47.65 82.84 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 123.128 0.571 . . . . 0.0 111.287 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 558' ' ' ASP . 38.2 t -69.81 -30.03 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 C-N-CA 123.87 0.868 . . . . 0.0 112.236 -178.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.527 HD13 ' O ' ' A' ' 559' ' ' TYR . 1.3 mp -86.84 -48.98 15.27 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.489 0 CA-C-O 122.222 1.01 . . . . 0.0 109.346 -172.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . 0.432 ' HB3' ' O ' ' A' ' 560' ' ' VAL . 26.9 t-20 -78.26 4.35 13.0 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.18 -1.373 . . . . 0.0 109.582 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.478 ' CD ' HH21 ' A' ' 468' ' ' ARG . 2.5 tm-20 -65.3 -28.07 69.06 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 172.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . 0.456 ' HD2' ' OE1' ' A' ' 469' ' ' GLN . 68.4 mttm . . . . . 0 N--CA 1.477 0.9 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.068 175.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 5.8 mp . . . . . 0 N--CA 1.479 1.022 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . 0.484 ' OG ' ' HB2' ' A' ' 469' ' ' GLN . 21.9 t -111.27 124.16 51.67 Favored 'General case' 0 N--CA 1.405 -2.71 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -169.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -67.3 -28.84 68.33 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 168.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.484 ' HB2' ' OG ' ' A' ' 467' ' ' SER . 1.7 mp0 -68.66 -42.97 77.15 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 124.445 1.098 . . . . 0.0 110.18 -178.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.562 ' OE2' ' HB2' ' A' ' 501' ' ' ASN . 0.7 OUTLIER -68.61 -34.8 76.4 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.266 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -63.49 -36.09 82.6 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.178 172.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -62.65 -33.67 75.51 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.299 0.571 . . . . 0.0 109.91 176.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . 0.423 ' HA ' ' HB2' ' A' ' 476' ' ' PHE . 52.7 mt-10 -73.72 -28.69 61.84 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.808 175.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -69.07 -32.92 72.72 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 173.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -69.4 -40.93 77.06 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.504 174.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . 0.423 ' HB2' ' HA ' ' A' ' 473' ' ' GLU . 0.1 OUTLIER -59.37 -27.78 66.27 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.697 176.003 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 477' ' ' LEU . 19.4 mt -69.97 -8.97 53.34 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 178.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.489 ' HG3' ' N ' ' A' ' 479' ' ' HIS . 59.3 pttt -43.08 -51.13 5.96 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 124.386 1.054 . . . . 0.0 110.289 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.489 ' N ' ' HG3' ' A' ' 478' ' ' LYS . 3.9 p80 46.29 161.31 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 128.488 2.715 . . . . 0.0 116.218 178.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.425 ' HB2' ' HG2' ' A' ' 482' ' ' ARG . 65.2 mt -143.21 -154.66 0.54 Allowed 'General case' 0 C--N 1.281 -2.407 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 170.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.34 -28.27 19.94 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . 0.63 ' HG3' ' N ' ' A' ' 483' ' ' ASP . 23.2 ptt180 -64.41 -52.96 55.53 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.991 1.317 . . . . 0.0 113.078 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . 0.63 ' N ' ' HG3' ' A' ' 482' ' ' ARG 0.252 1.1 p30 -76.6 31.29 0.13 Allowed 'General case' 0 N--CA 1.419 -1.993 0 N-CA-C 117.172 2.286 . . . . 0.0 117.172 -164.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . 0.494 ' HD2' ' N ' ' A' ' 485' ' ' ASP . 0.1 OUTLIER -67.41 -28.43 67.91 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 170.695 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . 0.494 ' N ' ' HD2' ' A' ' 484' ' ' LYS . 4.7 p-10 -63.05 -44.77 94.92 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.304 174.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.45 ' HB ' ' HB2' ' A' ' 483' ' ' ASP . 43.5 m -65.17 -39.98 93.68 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 124.015 0.926 . . . . 0.0 110.17 -179.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -54.34 -54.46 40.07 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.208 174.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 36.2 tp -66.14 -34.22 77.55 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.671 -177.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -67.68 -31.13 70.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.714 -178.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.61 -41.55 19.35 Favored 'General case' 0 N--CA 1.401 -2.907 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.99 -52.11 66.87 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.264 1.826 . . . . 0.0 110.831 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.39 -20.08 59.15 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.313 -173.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 59.4 m -81.13 -47.23 13.77 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 119.917 -0.713 . . . . 0.0 111.982 -174.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 40.1 t -137.31 123.43 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 C-N-CA 120.464 -0.494 . . . . 0.0 109.813 -175.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -86.63 45.64 1.27 Allowed 'General case' 0 CA--C 1.55 0.965 0 CA-C-O 122.606 1.193 . . . . 0.0 110.146 -177.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.418 ' HG2' ' H ' ' A' ' 496' ' ' LYS . 50.9 pttt -89.16 14.83 9.92 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.659 -177.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.27 -11.05 48.1 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 -170.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -84.66 -22.66 29.78 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.875 0.845 . . . . 0.0 109.14 175.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -79.99 -43.58 21.75 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.4 m -54.94 154.05 5.69 Favored 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.876 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.562 ' HB2' ' OE2' ' A' ' 470' ' ' GLU . 12.7 t-20 -66.42 150.02 49.54 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 124.806 1.242 . . . . 0.0 111.496 -174.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -65.41 -21.73 66.7 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.048 0.539 . . . . 0.0 110.313 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . 0.645 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 49.3 m80 -61.43 -44.25 97.45 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -65.78 -31.73 72.87 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.331 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 508' ' ' PHE . 46.8 tttm -61.81 -52.93 62.15 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 122.635 0.374 . . . . 0.0 110.594 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.645 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.282 47.0 p90 -66.2 -25.19 66.81 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 117.516 -1.674 . . . . 0.0 111.863 -179.796 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 97.4 t -72.53 -40.38 63.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.367 174.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . 0.41 ' HB2' ' O ' ' A' ' 505' ' ' LYS . 8.2 m-85 -48.67 -50.47 32.97 Favored 'General case' 0 C--O 1.199 -1.6 0 C-N-CA 123.399 0.679 . . . . 0.0 109.526 171.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 513' ' ' ASP . 38.6 mt-10 -57.28 -49.7 75.26 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 506' ' ' TYR . 9.9 t -60.43 -53.82 43.51 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.832 0 O-C-N 123.75 0.656 . . . . 0.0 109.262 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.433 ' HA ' ' HB2' ' A' ' 514' ' ' PHE . 95.8 mt -69.24 -32.29 71.41 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 113.431 0.9 . . . . 0.0 113.431 -174.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -67.07 -49.47 64.99 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 509' ' ' GLU . 0.4 OUTLIER -58.55 -38.39 77.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.368 173.843 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . 0.75 ' O ' ' HA ' ' A' ' 518' ' ' ASN . 13.8 m-85 -75.75 -3.87 37.29 Favored 'General case' 0 C--O 1.186 -2.279 0 C-N-CA 124.886 1.275 . . . . 0.0 114.31 174.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . 0.499 ' O ' ' HB3' ' A' ' 518' ' ' ASN . 2.6 m-85 -82.83 -35.62 26.22 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 121.154 -0.966 . . . . 0.0 110.356 165.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -68.61 -47.17 67.35 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 170.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -99.02 61.45 1.25 Allowed 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 104.752 -2.314 . . . . 0.0 104.752 174.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . 0.75 ' HA ' ' O ' ' A' ' 514' ' ' PHE . 3.1 p-10 -59.61 -151.27 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 128.844 2.858 . . . . 0.0 116.125 -163.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . 0.358 3.3 p30 -31.54 -152.75 0.0 OUTLIER 'General case' 0 N--CA 1.528 3.441 0 N-CA-C 119.605 3.187 . . . . 0.0 119.605 -138.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -53.18 125.07 16.28 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 124.01 1.862 . . . . 0.0 114.937 -145.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.83 176.58 6.21 Favored 'General case' 0 N--CA 1.416 -2.134 0 CA-C-N 109.648 -3.433 . . . . 0.0 110.483 -168.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -108.03 136.51 47.6 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -174.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 36.8 pt -79.19 -14.48 13.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 175.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.469 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 37.0 t -57.13 -30.97 64.87 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.642 172.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -63.03 -42.58 99.82 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -62.17 -45.27 94.17 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.295 177.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 530' ' ' VAL . 61.8 t -62.1 -26.07 39.12 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.702 0 CA-C-O 121.493 0.663 . . . . 0.0 111.186 175.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . 0.64 HE21 ' HA ' ' A' ' 528' ' ' GLN . 0.0 OUTLIER -71.16 -23.53 62.08 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 120.759 -1.213 . . . . 0.0 109.709 174.811 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.455 ' O ' ' HD3' ' A' ' 536' ' ' ARG . 16.2 m-85 -70.61 -31.71 68.78 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.901 174.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 527' ' ' VAL 0.326 14.6 p -74.97 54.73 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.321 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -172.406 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -107.02 -42.26 4.95 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 173.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . 0.416 ' HB2' ' HD2' ' A' ' 536' ' ' ARG . 11.7 m -79.0 141.44 37.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 106.004 -1.85 . . . . 0.0 106.004 171.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -68.11 -84.0 0.03 OUTLIER 'General case' 0 C--O 1.198 -1.641 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 -173.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -52.63 -64.98 0.64 Allowed 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 116.113 1.894 . . . . 0.0 116.113 -166.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 44.8 tp -57.14 -57.05 14.3 Favored 'General case' 0 C--O 1.267 2.004 0 CA-C-O 122.579 1.18 . . . . 0.0 111.299 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.455 ' HD3' ' O ' ' A' ' 529' ' ' TYR . 62.8 mtt85 -76.19 -38.25 56.79 Favored 'General case' 0 N--CA 1.41 -2.462 0 CA-C-N 114.11 -1.405 . . . . 0.0 113.686 -171.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -61.27 -43.88 98.15 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 118.243 0.474 . . . . 0.0 110.042 175.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.469 ' O ' HD13 ' A' ' 542' ' ' LEU . 93.4 m -55.44 -43.39 75.37 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 123.779 0.674 . . . . 0.0 111.045 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . 0.459 ' HB2' ' OH ' ' A' ' 506' ' ' TYR . 0.4 OUTLIER -57.9 -45.3 86.67 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.514 177.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . 0.595 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 1.7 mp -58.28 -43.96 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 CA-C-O 121.009 0.433 . . . . 0.0 110.368 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 19.8 m -54.5 -41.98 70.23 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.211 174.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 538' ' ' THR . 9.1 mp -62.83 -42.12 99.6 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.909 0.484 . . . . 0.0 110.472 175.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 478' ' ' LYS . 40.5 tt0 -61.1 -37.23 82.01 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.166 0.986 . . . . 0.0 111.78 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . 0.595 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 72.8 mt-30 -68.83 -29.0 67.24 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.138 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -76.96 84.4 3.49 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-O 121.767 0.794 . . . . 0.0 111.576 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -136.87 136.58 38.85 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.568 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 6.8 mp -90.35 23.54 2.9 Favored 'General case' 0 C--N 1.299 -1.596 0 C-N-CA 124.288 1.035 . . . . 0.0 111.209 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.08 -23.34 66.44 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -170.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -70.08 -15.49 62.99 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.891 0.377 . . . . 0.0 111.033 176.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -117.61 118.32 35.26 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -84.63 38.74 0.7 Allowed 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.948 2.432 . . . . 0.0 110.968 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -128.5 48.61 2.29 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -70.03 66.82 0.27 Allowed 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -175.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.07 -21.86 65.87 Favored 'General case' 0 C--O 1.214 -0.789 0 C-N-CA 125.657 1.583 . . . . 0.0 109.114 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -45.37 -38.44 5.87 Favored 'General case' 0 C--O 1.197 -1.659 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.89 174.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 43.9 mt -70.93 -42.24 77.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 123.283 0.633 . . . . 0.0 109.545 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -60.49 -47.3 86.75 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 121.957 0.884 . . . . 0.0 109.389 176.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -57.64 -48.54 79.18 Favored 'General case' 0 C--O 1.211 -0.954 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.296 175.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . 0.446 ' O ' HG13 ' A' ' 563' ' ' ILE . 27.9 t80 -56.89 -53.86 53.17 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 125.47 1.508 . . . . 0.0 110.42 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 40.4 t -58.4 -54.98 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.225 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.598 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.4 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 2.4 t30 -63.68 -42.78 97.98 Favored 'General case' 0 C--O 1.181 -2.502 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.994 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 2.6 p -65.75 -33.64 64.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 118.158 0.435 . . . . 0.0 112.108 -173.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 559' ' ' TYR . 27.9 mt -84.82 -29.24 6.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.538 0.685 . . . . 0.0 109.567 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -78.47 -36.19 45.61 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.668 -178.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 561' ' ' ASN . 12.3 pt-20 -75.09 -7.65 54.34 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 122.186 0.993 . . . . 0.0 110.401 -177.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? . . . . . 0 N--CA 1.442 -0.842 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.988 177.913 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 92.6 mt . . . . . 0 N--CA 1.428 -1.559 0 N-CA-C 108.492 -0.929 . . . . 0.0 108.492 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . 0.547 ' O ' ' HG2' ' A' ' 470' ' ' GLU . 47.3 t -95.05 141.09 29.1 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.681 -174.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -65.67 -22.42 66.64 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.252 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -62.26 -36.93 83.57 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.46 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 467' ' ' SER . 14.4 pt-20 -74.96 -23.92 58.37 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.723 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -71.35 -36.49 71.52 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -63.04 -48.41 78.83 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -56.66 -41.7 77.71 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.179 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 9.9 mmt-85 -57.41 -40.89 79.27 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.163 0.506 . . . . 0.0 109.89 175.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . 0.647 ' O ' ' HG3' ' A' ' 478' ' ' LYS . . . -65.54 -40.22 92.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.939 -178.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.57 -48.04 76.48 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.857 0.837 . . . . 0.0 110.81 173.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 31.8 tp -70.26 -3.17 15.84 Favored 'General case' 0 CA--C 1.571 1.761 0 C-N-CA 126.289 1.836 . . . . 0.0 114.456 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.647 ' HG3' ' O ' ' A' ' 475' ' ' ALA . 35.4 mtmm -41.66 -63.47 0.71 Allowed 'General case' 0 N--CA 1.511 2.579 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -172.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.535 ' CG ' ' HA ' ' A' ' 543' ' ' GLU . 0.4 OUTLIER -170.15 89.7 0.16 Allowed 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 121.918 0.866 . . . . 0.0 110.425 -179.447 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.549 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 96.1 mt -133.12 100.27 4.82 Favored 'General case' 0 C--N 1.278 -2.511 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -83.6 -72.68 0.45 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 114.44 -1.255 . . . . 0.0 112.036 -171.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -9.02 50.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 -179.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . 0.549 ' HB2' ' HB3' ' A' ' 480' ' ' LEU . 0.7 OUTLIER -70.79 57.67 0.2 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 125.152 1.381 . . . . 0.0 113.957 -177.524 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . 0.418 ' HE3' ' OH ' ' A' ' 515' ' ' TYR . 20.6 ptmt -54.95 -40.59 70.11 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 123.572 0.749 . . . . 0.0 111.321 178.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -63.39 -44.96 93.2 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.543 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 26.8 m -62.68 -39.06 92.76 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.208 0.203 . . . . 0.0 111.365 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . 0.441 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 61.6 t80 -56.02 -49.64 73.12 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 176.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.9 -31.71 66.67 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.941 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -68.58 -37.71 80.09 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.951 0.9 . . . . 0.0 111.571 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -84.67 -23.66 29.32 Favored 'General case' 0 N--CA 1.413 -2.298 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . 0.441 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.1 OUTLIER -65.12 -46.11 82.32 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 176.213 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.38 -6.91 56.58 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.273 0.559 . . . . 0.0 111.247 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 36.8 t -78.8 -18.4 54.18 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 37.7 t -129.03 98.09 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.93 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.865 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -99.25 -6.75 27.5 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 171.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -88.45 18.87 4.18 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 127.212 2.205 . . . . 0.0 109.62 177.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -61.16 -0.62 0.36 Allowed 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 -172.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -75.75 -12.91 60.27 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 175.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -77.36 -12.84 60.0 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 114.297 -1.319 . . . . 0.0 110.941 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 14.1 p -54.98 133.49 48.46 Favored 'General case' 0 CA--C 1.485 -1.546 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -170.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 43.4 t-20 -73.73 137.9 44.29 Favored 'General case' 0 N--CA 1.413 -2.282 0 N-CA-C 104.551 -2.388 . . . . 0.0 104.551 170.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . 0.436 ' O ' ' HD1' ' A' ' 506' ' ' TYR . 46.4 tt0 -62.23 -18.58 61.54 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 118.858 0.754 . . . . 0.0 110.985 -172.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -60.36 -41.98 94.81 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.054 175.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -63.56 -36.71 84.7 Favored 'General case' 0 C--O 1.209 -1.029 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.229 174.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 1.2 tmtp? -64.11 -36.07 82.83 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.074 -175.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.556 ' O ' HG23 ' A' ' 510' ' ' VAL . 45.6 m-85 -60.3 -54.09 49.87 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.964 172.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.82 -48.22 88.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.593 -177.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -49.82 -49.9 47.22 Favored 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 123.363 0.414 . . . . 0.0 111.636 176.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -57.92 -49.11 77.88 Favored 'General case' 0 N--CA 1.461 0.123 0 O-C-N 123.698 0.624 . . . . 0.0 110.413 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 506' ' ' TYR . 60.2 t -55.36 -58.85 3.3 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.561 0 O-C-N 123.786 0.679 . . . . 0.0 110.707 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 9.5 mp -66.27 -44.5 83.41 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.04 -175.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 50.9 t-80 -62.17 -53.06 60.66 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.977 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.4 -29.32 63.63 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -173.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 21.7 m-30 -76.68 -47.55 21.7 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.659 177.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . 0.418 ' OH ' ' HE3' ' A' ' 484' ' ' LYS . 0.6 OUTLIER -52.3 -43.55 64.54 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.591 1.156 . . . . 0.0 109.466 176.246 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -68.65 -9.61 51.09 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -121.49 -48.23 2.19 Favored 'General case' 0 C--N 1.313 -1.014 0 O-C-N 121.917 -0.49 . . . . 0.0 111.694 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -121.16 -151.01 0.47 Allowed 'General case' 0 C--N 1.29 -1.984 0 C-N-CA 123.563 0.745 . . . . 0.0 109.386 -177.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.84 -160.62 0.16 Allowed 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -75.56 179.83 5.08 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.988 -0.445 . . . . 0.0 110.173 -178.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . 0.406 ' CD2' ' HB2' ' A' ' 525' ' ' ASP . 0.1 OUTLIER -88.55 138.35 31.5 Favored 'General case' 0 N--CA 1.384 -3.729 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -176.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -119.29 175.8 5.63 Favored 'General case' 0 C--N 1.286 -2.183 0 CA-C-N 116.946 -0.115 . . . . 0.0 110.796 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 35.0 pt -68.73 -18.56 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.302 0.573 . . . . 0.0 110.992 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 3.5 p -59.71 -41.33 90.58 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-O 121.787 0.803 . . . . 0.0 109.741 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . 0.406 ' HB2' ' CD2' ' A' ' 521' ' ' TYR . 40.9 m-20 -66.82 -36.91 83.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.001 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -59.8 -49.57 77.19 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.273 178.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 9.5 p -68.15 -23.62 28.98 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.721 0 CA-C-O 120.903 0.382 . . . . 0.0 110.909 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . 0.482 ' HG3' ' O ' ' A' ' 524' ' ' SER . 26.6 mt-30 -67.28 -30.37 70.22 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 173.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.401 ' C ' ' H ' ' A' ' 531' ' ' ASN . 0.3 OUTLIER -83.17 16.59 2.35 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 173.497 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.417 HG23 ' HG3' ' A' ' 536' ' ' ARG . 5.2 p -71.63 18.89 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 CA-C-O 121.928 0.871 . . . . 0.0 111.729 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . 0.401 ' H ' ' C ' ' A' ' 529' ' ' TYR . 10.4 p30 -107.86 -26.16 10.88 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.579 -0.701 . . . . 0.0 111.036 -178.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . 0.445 ' HB2' ' HB2' ' A' ' 535' ' ' LEU . 24.8 m -92.2 140.03 30.03 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 179.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . 0.539 ' O ' ' HG2' ' A' ' 537' ' ' GLU . 19.3 m120 -57.84 -72.23 0.09 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -170.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -66.39 -32.45 73.85 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 120.67 0.271 . . . . 0.0 111.158 -174.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 532' ' ' SER . 3.7 mm? -61.88 -50.51 71.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.391 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.417 ' HG3' HG23 ' A' ' 530' ' ' VAL . 48.4 ttt180 -62.3 -61.53 2.39 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.869 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 533' ' ' ASN . 12.7 pt-20 -61.22 -62.27 1.96 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -173.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.482 ' O ' HD13 ' A' ' 542' ' ' LEU . 75.7 m -65.27 -53.77 39.21 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . 0.435 ' HB3' ' O ' ' A' ' 535' ' ' LEU . 47.4 tp -61.38 -44.03 97.85 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.468 -174.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 57.2 mt -68.18 -34.83 68.68 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.492 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 28.7 t -57.35 -49.22 76.84 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 121.555 0.693 . . . . 0.0 109.477 174.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.482 HD13 ' O ' ' A' ' 538' ' ' THR . 6.5 mp -66.96 -24.41 66.05 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.979 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . 0.535 ' HA ' ' CG ' ' A' ' 479' ' ' HIS . 0.9 OUTLIER -81.42 -64.7 1.13 Allowed 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.04 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -71.67 -59.59 2.68 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.857 -171.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -73.04 90.28 1.5 Allowed 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -173.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -137.26 100.17 4.18 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 173.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 5.5 tt -92.35 -82.54 0.32 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 118.589 -1.244 . . . . 0.0 111.518 -173.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -104.66 -48.99 3.64 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-O 121.743 0.782 . . . . 0.0 112.137 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -68.23 36.25 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 126.842 2.057 . . . . 0.0 113.824 -172.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.44 ' HA ' ' HD3' ' A' ' 551' ' ' PRO . 12.2 pt-20 -54.97 106.11 0.62 Allowed Pre-proline 0 C--O 1.244 0.798 0 C-N-CA 123.479 0.711 . . . . 0.0 112.174 -179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 550' ' ' GLU . 43.6 Cg_endo -92.72 111.55 0.24 Allowed 'Trans proline' 0 N--CA 1.426 -2.443 0 C-N-CA 122.596 2.197 . . . . 0.0 114.389 -173.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -131.26 -54.14 1.03 Allowed 'General case' 0 CA--C 1.494 -1.209 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 172.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -75.02 -50.22 17.23 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 113.853 -1.521 . . . . 0.0 108.585 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -67.1 -24.16 65.91 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 114.27 -1.332 . . . . 0.0 109.052 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . 0.426 ' CD ' ' HB1' ' A' ' 475' ' ' ALA . 6.1 tp10 -68.07 -56.61 8.25 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.58 -177.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 72.8 mt -54.71 -40.92 53.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.21 -51.67 68.79 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.431 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -66.16 -49.45 67.34 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.192 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . 0.613 ' O ' HG12 ' A' ' 563' ' ' ILE . 87.5 t80 -51.49 -53.44 37.37 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 125.352 1.461 . . . . 0.0 110.233 178.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 75.7 t -61.41 -45.92 97.64 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.985 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -58.46 -39.72 80.68 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.741 0.416 . . . . 0.0 111.324 -179.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 76.3 t -70.12 -34.87 61.05 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 123.187 0.595 . . . . 0.0 112.246 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.613 HG12 ' O ' ' A' ' 559' ' ' TYR . 47.7 mm -86.37 -38.32 12.42 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -174.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -76.82 0.14 21.83 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 113.956 -1.475 . . . . 0.0 109.646 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -64.54 -36.17 83.35 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 104.781 -2.303 . . . . 0.0 104.781 173.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . 0.433 ' O ' ' HG2' ' A' ' 566' ' ' LYS . 54.1 tttm . . . . . 0 CA--C 1.553 1.071 0 CA-C-N 113.525 -1.67 . . . . 0.0 108.27 -179.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 96.1 mt . . . . . 0 N--CA 1.44 -0.949 0 CA-C-O 121.391 0.615 . . . . 0.0 109.385 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 67.2 p -101.94 -177.84 3.53 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.191 -174.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.3 ptt180 -69.36 -18.19 63.76 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.235 173.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.434 ' HA ' HG12 ' A' ' 562' ' ' VAL . 98.6 mt-30 -57.54 -67.62 0.31 Allowed 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 -168.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.494 ' HA ' ' CB ' ' A' ' 473' ' ' GLU 0.449 11.7 pt-20 -77.1 -9.06 58.49 Favored 'General case' 0 N--CA 1.421 -1.887 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -177.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -67.07 -44.46 80.03 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 170.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . 0.467 ' HB3' HD11 ' A' ' 563' ' ' ILE . . . -67.86 -27.78 66.98 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.768 0.794 . . . . 0.0 109.184 176.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . 0.494 ' CB ' ' HA ' ' A' ' 470' ' ' GLU . 0.1 OUTLIER -70.18 -45.14 67.3 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 114.67 -1.15 . . . . 0.0 108.541 177.801 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 67.7 mtt180 -57.06 -35.31 69.19 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.19 0.519 . . . . 0.0 110.89 172.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . 0.401 ' HA ' HD12 ' A' ' 542' ' ' LEU . . . -69.5 -39.35 77.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.591 175.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . 0.554 ' O ' ' HB2' ' A' ' 479' ' ' HIS . 4.2 t80 -64.49 -38.39 90.84 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 123.69 0.796 . . . . 0.0 110.097 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 56.3 tp -63.47 -43.35 97.57 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.44 1.096 . . . . 0.0 111.162 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -74.61 -53.37 9.49 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.554 ' HB2' ' O ' ' A' ' 476' ' ' PHE . 1.7 t-80 40.05 -97.15 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.096 2.159 . . . . 0.0 113.326 177.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.457 ' H ' ' HB3' ' A' ' 479' ' ' HIS . 3.2 mm? -136.27 153.24 51.25 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 173.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . 0.567 ' HG3' ' O ' ' A' ' 521' ' ' TYR . 58.7 ttp -54.29 -34.98 62.09 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 122.987 0.515 . . . . 0.0 112.316 -177.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 19.7 ptt-85 -66.83 -17.49 64.91 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -177.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . 0.47 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 4.6 m-20 -70.55 41.28 0.06 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 116.505 2.039 . . . . 0.0 116.505 -169.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . 0.584 ' HD2' ' CD2' ' A' ' 515' ' ' TYR . 30.6 mmtp -60.88 -42.77 98.59 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-O 121.136 0.493 . . . . 0.0 110.983 174.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -60.93 -50.41 73.52 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.093 178.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.47 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 59.3 m -58.32 -43.05 88.03 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 123.952 0.901 . . . . 0.0 111.266 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . 0.489 ' CE1' ' HB3' ' A' ' 511' ' ' LEU . 82.5 t80 -46.19 -55.35 7.23 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.748 1.219 . . . . 0.0 109.893 175.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 60.0 mt -79.02 -27.36 43.23 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -67.07 -41.31 86.64 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.82 -38.7 20.9 Favored 'General case' 0 N--CA 1.424 -1.764 0 C-N-CA 120.116 -0.634 . . . . 0.0 109.786 -177.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 28.9 t80 -55.14 -58.2 8.64 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -77.82 -14.38 59.59 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 120.372 -0.531 . . . . 0.0 112.221 -170.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 43.5 m -82.31 -60.99 2.02 Favored 'General case' 0 N--CA 1.425 -1.68 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -173.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . 0.412 HG12 ' O ' ' A' ' 495' ' ' ASP . 87.6 t -139.14 134.97 41.71 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 120.353 -0.539 . . . . 0.0 112.125 -167.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . 0.412 ' O ' HG12 ' A' ' 494' ' ' VAL . 12.0 m-20 -85.87 158.95 19.82 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 170.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.469 ' H ' ' HE3' ' A' ' 496' ' ' LYS . 0.0 OUTLIER -89.23 -90.89 0.13 Allowed 'General case' 0 CA--C 1.5 -0.962 0 C-N-CA 116.459 -2.096 . . . . 0.0 112.152 -167.08 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -106.25 -85.22 0.5 Allowed 'General case' 0 N--CA 1.431 -1.375 0 C-N-CA 114.444 -2.903 . . . . 0.0 113.02 171.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -127.79 -50.67 1.36 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.524 1.53 . . . . 0.0 114.991 171.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . 0.357 10.8 p90 -70.57 -93.15 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.831 1 N-CA-C 123.904 4.779 . . . . 0.0 123.904 -149.646 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 11.4 m -93.45 89.7 6.42 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -161.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -127.25 42.02 3.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 117.769 -1.573 . . . . 0.0 114.227 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . 0.428 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 1.1 tm0? -90.13 -35.06 15.63 Favored 'General case' 0 CA--C 1.502 -0.902 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 168.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . 0.741 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 87.3 m-70 -62.86 -40.64 98.11 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.111 -178.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . 0.457 ' O ' ' HD2' ' A' ' 508' ' ' PHE . 37.2 m-85 -63.85 -40.78 97.37 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.169 175.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.428 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 54.2 tttp -58.77 -50.36 74.21 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 123.688 0.795 . . . . 0.0 109.7 -175.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.741 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.279 9.8 p90 -65.02 -36.62 84.98 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 118.261 -1.375 . . . . 0.0 113.265 178.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.85 -48.75 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 120.311 -0.555 . . . . 0.0 109.802 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . 0.457 ' HD2' ' O ' ' A' ' 504' ' ' PHE . 32.3 m-85 -51.79 -39.39 58.57 Favored 'General case' 0 CA--C 1.499 -0.998 0 O-C-N 123.826 0.704 . . . . 0.0 112.637 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -58.39 -61.17 2.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.747 0.654 . . . . 0.0 109.512 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 506' ' ' TYR . 32.0 t -58.29 -48.94 83.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.389 -176.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.489 ' HB3' ' CE1' ' A' ' 487' ' ' PHE . 2.9 tt -68.61 -40.83 80.23 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.802 -172.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -70.09 -35.11 73.94 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.89 -49.16 77.33 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.172 0.589 . . . . 0.0 110.427 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -63.45 -44.13 95.38 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.952 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . 0.584 ' CD2' ' HD2' ' A' ' 484' ' ' LYS . 0.7 OUTLIER -52.98 -42.32 65.43 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 124.142 0.977 . . . . 0.0 109.773 179.641 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.84 -21.34 63.38 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -116.03 -53.85 2.53 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-O 121.87 0.843 . . . . 0.0 112.198 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . 0.566 ' CG ' ' H ' ' A' ' 519' ' ' ASP . 22.8 t-20 -101.88 -152.36 0.44 Allowed 'General case' 0 C--N 1.281 -2.38 0 CA-C-N 114.161 -1.381 . . . . 0.0 110.248 -169.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . 0.566 ' H ' ' CG ' ' A' ' 518' ' ' ASN . 29.1 t70 -106.17 -158.15 0.64 Allowed 'General case' 0 C--N 1.272 -2.78 0 C-N-CA 128.505 2.722 . . . . 0.0 105.664 -170.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . 0.568 ' HA ' ' HE3' ' A' ' 484' ' ' LYS 0.412 3.5 pm0 -62.95 155.08 28.38 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 120.501 1.501 . . . . 0.0 112.71 178.25 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . 0.567 ' O ' ' HG3' ' A' ' 481' ' ' MET . 0.3 OUTLIER -84.06 131.46 34.8 Favored 'General case' 0 N--CA 1.397 -3.101 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -167.006 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -72.38 146.51 46.99 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.014 -178.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . 0.46 ' HB ' ' OE2' ' A' ' 543' ' ' GLU . 39.1 pt -84.29 -12.02 11.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.489 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 35.7 t -56.84 -38.54 72.8 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.869 175.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -64.62 -34.45 78.3 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.53 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -61.95 -39.6 92.66 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.114 176.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 56.5 t -71.17 -37.22 65.65 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.115 0 C-N-CA 124.083 0.953 . . . . 0.0 108.729 177.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.2 mm100 -67.3 -10.48 51.3 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 122.711 0.405 . . . . 0.0 111.119 178.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.53 ' HB2' ' O ' ' A' ' 526' ' ' ALA . 4.9 m-85 -71.13 -0.02 8.72 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.645 168.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.53 ' HA ' ' CB ' ' A' ' 536' ' ' ARG . 6.3 p -73.03 15.27 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.642 0 CA-C-O 122.288 1.042 . . . . 0.0 110.469 174.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 529' ' ' TYR . 5.9 t30 -97.12 -24.8 15.58 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 174.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 31.8 t -91.75 141.68 28.41 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 114.963 -1.017 . . . . 0.0 108.785 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -65.86 -51.04 62.17 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -175.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -94.95 -37.83 10.97 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.145 0.498 . . . . 0.0 111.204 -177.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.412 HD22 ' OH ' ' A' ' 506' ' ' TYR . 45.8 mt -66.32 -21.49 66.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.708 -174.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.53 ' CB ' ' HA ' ' A' ' 530' ' ' VAL . 36.3 ptt180 -63.47 -46.42 86.29 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.21 -49.85 75.47 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.525 -178.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 541' ' ' SER . 5.7 m -61.01 -54.52 43.95 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -178.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . 0.31 4.2 mm? -65.28 -35.62 81.58 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -177.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 72.1 mt -72.0 -29.64 33.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.91 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . 0.447 ' HB2' ' O ' ' A' ' 538' ' ' THR . 73.3 m -57.41 -40.76 78.99 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.669 0.747 . . . . 0.0 109.544 168.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 475' ' ' ALA . 3.3 mm? -74.67 -13.08 60.58 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 174.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . 0.46 ' OE2' ' HB ' ' A' ' 523' ' ' ILE . 53.9 mm-40 -80.47 -40.75 25.63 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.246 0.546 . . . . 0.0 111.146 174.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -77.58 27.36 0.17 Allowed 'General case' 0 CA--C 1.557 1.224 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -176.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -67.84 163.7 21.31 Favored 'General case' 0 C--O 1.242 0.705 0 O-C-N 122.237 -0.289 . . . . 0.0 110.688 177.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -93.1 155.02 17.76 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.876 -0.329 . . . . 0.0 111.307 -177.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 88.2 mt -77.47 22.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.431 1.092 . . . . 0.0 111.952 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . 0.452 ' C ' ' H ' ' A' ' 550' ' ' GLU . 2.6 t-20 -79.8 21.32 0.55 Allowed 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 122.082 0.944 . . . . 0.0 110.183 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -70.08 9.65 0.53 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 125.601 1.56 . . . . 0.0 111.626 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.452 ' H ' ' C ' ' A' ' 548' ' ' ASN . 34.9 mt-10 -54.9 154.66 9.33 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 125.917 1.687 . . . . 0.0 111.873 -175.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -71.83 45.16 0.7 Allowed 'Trans proline' 0 N--CA 1.503 2.033 0 C-N-CA 124.666 3.577 . . . . 0.0 112.807 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -134.92 50.49 2.16 Favored 'General case' 0 C--N 1.282 -2.334 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 178.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -56.66 67.35 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 117.153 2.279 . . . . 0.0 117.153 -169.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . 0.455 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 7.6 t30 -70.65 -22.08 62.54 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.919 1.287 . . . . 0.0 107.786 171.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -44.93 -54.53 6.39 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.537 1.535 . . . . 0.0 110.029 177.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 54.6 mt -62.7 -38.86 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.396 0.678 . . . . 0.0 110.284 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . 0.455 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 3.2 t70 -56.57 -51.25 69.32 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 121.071 0.462 . . . . 0.0 110.611 177.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . 0.501 ' O ' HG23 ' A' ' 562' ' ' VAL . 29.6 t70 -67.13 -47.41 71.17 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.999 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . 0.409 ' O ' HD13 ' A' ' 563' ' ' ILE . 77.6 t80 -51.99 -53.37 42.48 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.998 1.319 . . . . 0.0 111.456 179.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.28 -44.24 95.26 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.679 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 9.3 t30 -63.09 -36.33 83.22 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 122.774 0.43 . . . . 0.0 112.143 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 558' ' ' ASP . 89.7 t -70.97 -50.3 43.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-O 121.591 0.71 . . . . 0.0 111.493 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.54 ' O ' ' HG3' ' A' ' 566' ' ' LYS . 1.7 mp -80.7 -55.5 8.34 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.882 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.465 -168.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -74.57 1.09 12.88 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 122.091 0.948 . . . . 0.0 111.041 -173.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 45.2 tt0 -67.2 -14.71 63.17 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 169.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 563' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--N 1.357 0.931 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.781 173.547 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 91.5 mt . . . . . 0 N--CA 1.438 -1.065 0 CA-C-O 120.718 0.294 . . . . 0.0 111.505 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 41.0 t -109.53 104.16 13.17 Favored 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 173.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -70.81 -29.13 65.22 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.551 -0.46 . . . . 0.0 112.2 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -67.65 -54.3 20.77 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.057 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.624 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 32.0 tt0 -63.48 -36.67 84.51 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -58.18 -42.43 86.06 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.483 177.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -65.65 -43.43 89.42 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.089 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.72 -44.5 93.7 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.457 0.703 . . . . 0.0 110.924 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.624 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 92.4 mtt180 -53.46 -54.27 39.4 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.296 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . 0.438 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -69.56 -43.47 72.83 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 124.146 0.903 . . . . 0.0 112.265 -178.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -55.12 -36.65 65.95 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.019 0.927 . . . . 0.0 111.727 -176.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.494 HD11 HG11 ' A' ' 507' ' ' VAL . 1.2 tm? -57.38 -31.34 65.7 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 113.866 -1.516 . . . . 0.0 111.277 -176.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.477 ' HD3' ' O ' ' A' ' 542' ' ' LEU . 12.4 pttt -71.65 -19.87 62.03 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -172.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.4 ' N ' ' HG3' ' A' ' 478' ' ' LYS . 9.0 t-160 -119.92 9.09 11.18 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 118.239 -1.384 . . . . 0.0 112.832 -171.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.498 ' HB2' HG23 ' A' ' 486' ' ' THR 0.264 1.1 pp -91.58 72.07 5.91 Favored 'General case' 0 C--O 1.194 -1.83 0 CA-C-O 122.739 1.256 . . . . 0.0 110.982 175.812 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -98.67 9.45 43.29 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . 0.651 ' O ' ' HG2' ' A' ' 520' ' ' GLN . 97.7 mtt180 -66.56 -97.8 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 119.946 1.248 . . . . 0.0 114.282 -171.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . 0.278 1.1 p30 -143.64 -84.87 0.15 Allowed 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.034 2.235 . . . . 0.0 117.034 168.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt -95.43 -41.3 9.05 Favored 'General case' 0 CA--C 1.485 -1.551 0 CA-C-O 121.893 0.854 . . . . 0.0 109.414 -178.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 489' ' ' ASN . 9.7 p-10 -51.1 -38.4 51.6 Favored 'General case' 0 C--O 1.173 -2.965 0 CA-C-N 112.683 -2.053 . . . . 0.0 109.211 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.498 HG23 ' HB2' ' A' ' 480' ' ' LEU . 3.1 m -59.05 -51.44 70.03 Favored 'General case' 0 N--CA 1.419 -1.98 0 C-N-CA 125.907 1.683 . . . . 0.0 113.343 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -66.13 -44.72 83.44 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -174.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 59.4 mt -76.33 -21.75 55.8 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.356 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 485' ' ' ASP . 57.7 t30 -65.6 -40.39 92.59 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 123.008 0.523 . . . . 0.0 109.97 -177.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -83.96 -54.31 4.96 Favored 'General case' 0 N--CA 1.425 -1.704 0 C-N-CA 119.19 -1.004 . . . . 0.0 109.749 175.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -58.92 -35.96 73.96 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -171.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -83.23 -23.14 32.89 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 121.347 0.594 . . . . 0.0 111.347 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 15.8 m -83.98 -41.67 17.06 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -175.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 40.0 t -101.87 161.73 3.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.361 -173.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.81 101.95 14.7 Favored 'General case' 0 CA--C 1.495 -1.169 0 CA-C-O 121.1 0.476 . . . . 0.0 111.352 177.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -57.99 -36.81 73.16 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.929 -176.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -73.74 -28.35 61.65 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -83.36 -56.64 3.64 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 121.744 0.783 . . . . 0.0 109.113 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -77.57 11.64 1.96 Allowed 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -174.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 5.1 m -52.5 99.88 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.753 0.787 . . . . 0.0 111.896 -173.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.492 ' HB3' ' CD2' ' A' ' 504' ' ' PHE . 23.2 t-20 -119.3 154.76 33.01 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 178.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 47.5 tp60 -58.99 -31.8 69.1 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 123.715 0.806 . . . . 0.0 110.312 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -59.01 -53.96 52.46 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 124.181 0.992 . . . . 0.0 108.685 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . 0.492 ' CD2' ' HB3' ' A' ' 501' ' ' ASN . 22.0 m-85 -66.42 -35.1 79.47 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.425 -178.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -64.36 -49.34 72.01 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 123.199 0.599 . . . . 0.0 110.269 -176.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.53 ' O ' HG23 ' A' ' 510' ' ' VAL . 9.2 m-85 -60.09 -54.87 40.81 Favored 'General case' 0 N--CA 1.439 -0.991 0 O-C-N 123.855 0.722 . . . . 0.0 111.953 178.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . 0.494 HG11 HD11 ' A' ' 477' ' ' LEU . 54.5 t -60.48 -48.04 90.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.349 -176.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -49.69 -50.31 44.19 Favored 'General case' 0 C--O 1.218 -0.567 0 O-C-N 123.568 0.543 . . . . 0.0 111.117 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -63.46 -53.73 47.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 506' ' ' TYR . 42.8 t -57.96 -45.95 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 121.217 0.532 . . . . 0.0 110.407 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 507' ' ' VAL . 0.4 OUTLIER -66.4 -48.66 69.36 Favored 'General case' 0 N--CA 1.419 -2.001 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.976 -176.352 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -60.01 -42.96 95.45 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.152 0.581 . . . . 0.0 110.651 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -71.15 -43.34 67.73 Favored 'General case' 0 C--N 1.313 -0.991 0 O-C-N 123.405 0.441 . . . . 0.0 112.179 -173.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . 0.412 ' HA ' ' HG2' ' A' ' 517' ' ' GLU . 65.1 m-85 -73.92 -42.16 61.02 Favored 'General case' 0 C--O 1.199 -1.605 0 C-N-CA 119.289 -0.964 . . . . 0.0 111.607 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -54.74 -32.06 59.24 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.454 0.701 . . . . 0.0 110.311 176.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -70.23 -24.37 63.08 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.409 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.412 ' HG2' ' HA ' ' A' ' 514' ' ' PHE . 10.0 pt-20 -110.03 -44.05 3.86 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -176.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . 0.408 ' HB3' ' H ' ' A' ' 519' ' ' ASP . 92.1 m-20 -135.38 -152.16 0.45 Allowed 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 124.355 1.062 . . . . 0.0 109.592 -172.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . 0.408 ' H ' ' HB3' ' A' ' 518' ' ' ASN . 3.4 p-10 -79.32 -164.54 0.64 Allowed 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 125.093 1.357 . . . . 0.0 111.683 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . 0.651 ' HG2' ' O ' ' A' ' 482' ' ' ARG . 0.0 OUTLIER -73.78 -178.79 3.33 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 115.933 1.827 . . . . 0.0 115.933 -171.227 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . 0.433 ' CB ' ' HG ' ' A' ' 511' ' ' LEU . 12.0 t80 -103.21 138.03 40.56 Favored 'General case' 1 N--CA 1.362 -4.863 0 C-N-CA 125.384 1.473 . . . . 0.0 107.49 -177.321 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -118.99 167.79 11.42 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.6 pp -70.36 -8.63 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 121.512 0.672 . . . . 0.0 110.726 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 12.8 m -56.19 -40.47 74.01 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.787 173.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -71.41 -40.51 70.42 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -59.29 -48.11 82.86 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.878 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.672 ' O ' HG12 ' A' ' 530' ' ' VAL . 10.3 p -67.65 -28.55 42.19 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.854 0 CA-C-O 121.314 0.578 . . . . 0.0 110.71 177.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -70.7 -20.77 62.64 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.6 ' O ' ' HG2' ' A' ' 536' ' ' ARG . 2.0 m-85 -74.57 -23.41 58.76 Favored 'General case' 0 CA--C 1.494 -1.184 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.672 HG12 ' O ' ' A' ' 527' ' ' VAL . 10.0 p -74.03 52.57 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.898 0 CA-C-O 123.226 1.488 . . . . 0.0 114.839 -171.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -107.64 -34.14 7.09 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 173.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.54 144.79 25.43 Favored 'General case' 0 N--CA 1.424 -1.737 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 171.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . 0.257 7.2 p30 -76.34 -69.0 0.53 Allowed 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 -168.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . 0.401 ' CD ' ' H ' ' A' ' 535' ' ' LEU 0.258 0.0 OUTLIER -50.24 -73.16 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 117.479 2.4 . . . . 0.0 117.479 -164.911 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.401 ' H ' ' CD ' ' A' ' 534' ' ' GLU . 58.8 tp -71.91 -31.98 66.94 Favored 'General case' 0 C--N 1.28 -2.453 0 CA-C-O 121.646 0.736 . . . . 0.0 111.236 -172.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 529' ' ' TYR . 8.2 mpt_? -75.02 -44.0 50.48 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.34 -173.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -60.73 -40.21 91.5 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.465 ' O ' HD13 ' A' ' 542' ' ' LEU . 57.2 m -54.38 -49.14 70.56 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.908 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 539' ' ' LEU . 4.1 mm? -59.17 -38.24 79.29 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 49.9 mm -68.29 -40.67 82.93 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 35.2 t -58.47 -45.46 88.61 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.696 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.477 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 6.8 mp -64.78 -30.08 71.07 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.959 177.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . 0.457 ' HA ' ' CD ' ' A' ' 478' ' ' LYS . 0.2 OUTLIER -76.29 -34.4 59.09 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 177.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -62.67 -36.11 81.83 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.374 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -67.67 113.39 5.42 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 172.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -134.52 103.08 5.54 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-O 121.962 0.887 . . . . 0.0 111.929 -178.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.427 ' HG ' ' ND2' ' A' ' 554' ' ' ASN . 40.8 tp -91.85 -12.54 33.36 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.591 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -70.1 18.94 0.05 OUTLIER 'General case' 0 CA--C 1.559 1.31 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 -173.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -68.76 -31.39 70.39 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.65 0.738 . . . . 0.0 112.11 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.483 ' HB2' ' HD2' ' A' ' 551' ' ' PRO . 12.5 pt-20 -95.71 -178.97 0.84 Allowed Pre-proline 0 C--N 1.3 -1.582 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . 0.483 ' HD2' ' HB2' ' A' ' 550' ' ' GLU . 83.9 Cg_exo -47.6 137.85 19.89 Favored 'Trans proline' 0 C--N 1.386 2.527 0 C-N-CA 121.811 1.674 . . . . 0.0 110.299 175.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -74.01 4.73 5.04 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 121.908 0.861 . . . . 0.0 112.866 -167.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . 0.473 ' HA ' HG12 ' A' ' 556' ' ' ILE . 1.9 mp0 -74.94 -12.6 60.39 Favored 'General case' 0 N--CA 1.408 -2.565 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.859 176.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . 0.427 ' ND2' ' HG ' ' A' ' 547' ' ' LEU . 28.0 p-10 -69.75 -24.4 63.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -80.34 -56.38 4.24 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -177.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . 0.473 HG12 ' HA ' ' A' ' 553' ' ' GLU . 34.0 pt -64.69 -38.24 82.16 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.87 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . 0.401 ' HA ' HG12 ' A' ' 560' ' ' VAL . 36.2 t70 -63.94 -45.08 90.77 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -65.37 -45.78 82.73 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -56.22 -52.58 63.92 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 113.985 -1.461 . . . . 0.0 111.291 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 556' ' ' ILE . 13.2 p -65.94 -36.01 76.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.353 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.515 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 27.3 t-20 -62.55 -32.73 73.73 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.349 0.595 . . . . 0.0 110.232 176.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 70.2 t -77.35 -56.94 6.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 CA-C-N 115.553 -0.748 . . . . 0.0 112.522 175.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . . . . . . . . . 50.7 mm -74.77 -49.74 28.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.418 -169.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -80.78 -3.29 50.45 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.575 -174.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 29.4 tt0 -64.11 -32.75 74.43 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 168.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 64.7 mttm . . . . . 0 C--N 1.317 -0.838 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.046 174.754 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 82.1 mt . . . . . 0 N--CA 1.434 -1.238 0 CA-C-O 121.572 0.701 . . . . 0.0 110.529 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.7 m -106.12 -170.71 1.77 Allowed 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.187 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . 0.426 ' O ' ' HB3' ' A' ' 471' ' ' LYS . 39.0 ttm180 -58.22 -24.17 58.29 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.199 1.0 . . . . 0.0 111.24 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.535 ' NE2' ' HB2' ' A' ' 566' ' ' LYS . 20.9 mp0 -60.11 -24.84 64.98 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.813 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.423 ' O ' ' HB2' ' A' ' 474' ' ' ARG . 8.3 tm-20 -66.48 -34.71 78.55 Favored 'General case' 0 C--O 1.206 -1.227 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 468' ' ' ARG . 13.3 tmtt? -66.36 -39.64 89.28 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.327 176.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . 0.4 ' HB2' HG11 ' A' ' 562' ' ' VAL . . . -63.37 -49.3 74.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.839 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 469' ' ' GLN . 36.6 mt-10 -67.71 -34.55 77.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.853 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 470' ' ' GLU . 37.2 ttp180 -61.08 -45.55 94.26 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 123.987 0.915 . . . . 0.0 109.681 175.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . 0.462 ' HA ' HD23 ' A' ' 542' ' ' LEU . . . -68.3 -41.83 80.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.74 -179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -60.03 -51.06 71.25 Favored 'General case' 0 C--O 1.24 0.589 0 O-C-N 123.677 0.611 . . . . 0.0 110.27 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.511 HD21 HG11 ' A' ' 507' ' ' VAL . 1.6 tt -57.8 -38.91 76.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.623 -1.171 . . . . 0.0 111.861 178.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.433 ' HB2' HD11 ' A' ' 539' ' ' LEU . 23.7 tptp -82.39 -13.94 56.01 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.714 -175.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.412 ' CE1' ' HB2' ' A' ' 552' ' ' TYR . 6.4 t60 -85.79 -53.86 4.87 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.325 -172.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.597 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 96.0 mt -101.71 107.69 18.99 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 121.766 0.793 . . . . 0.0 112.719 -173.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 53.1 mtt -94.74 -44.0 7.99 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.766 -174.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . 0.458 ' HG2' ' OE1' ' A' ' 520' ' ' GLN . 99.2 mtt180 -70.03 -31.14 68.64 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 122.378 1.085 . . . . 0.0 110.848 -179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . 0.597 ' HB2' ' HB3' ' A' ' 480' ' ' LEU . 4.7 m-20 -70.63 61.01 0.23 Allowed 'General case' 0 C--N 1.252 -3.653 0 C-N-CA 127.496 2.318 . . . . 0.0 116.83 -170.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . 0.565 ' HD3' ' OD2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -39.66 -41.51 1.07 Allowed 'General case' 0 N--CA 1.52 3.06 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 172.329 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -52.21 -52.93 49.32 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.053 0.941 . . . . 0.0 110.77 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.5 ' O ' ' HB3' ' A' ' 490' ' ' TYR . 68.0 m -64.14 -35.79 81.93 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.514 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -51.21 -54.07 29.13 Favored 'General case' 0 C--N 1.349 0.578 0 O-C-N 123.12 0.263 . . . . 0.0 110.634 177.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -78.54 -33.23 48.02 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 119.237 -0.985 . . . . 0.0 112.064 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.37 -32.83 74.02 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.176 0.512 . . . . 0.0 110.743 -176.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . 0.5 ' HB3' ' O ' ' A' ' 486' ' ' THR . 0.0 OUTLIER -86.59 -45.44 11.04 Favored 'General case' 0 N--CA 1.389 -3.513 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -56.12 -39.38 72.14 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -70.52 -25.15 62.99 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.505 0.669 . . . . 0.0 110.079 -176.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 23.1 m -90.01 -16.59 29.5 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 123.548 0.739 . . . . 0.0 112.641 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . 0.495 HG21 ' CE2' ' A' ' 490' ' ' TYR . 79.5 t -117.95 144.7 25.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -166.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . 0.517 ' OD2' ' HA ' ' A' ' 500' ' ' THR . 12.7 t70 71.49 -36.75 0.37 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 117.017 2.228 . . . . 0.0 117.017 167.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -41.8 -67.52 0.25 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -166.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . 0.264 8.6 m-20 -80.92 -73.22 0.38 Allowed 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 -175.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -101.41 -37.05 8.62 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -172.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -76.25 11.14 1.63 Allowed 'General case' 0 CA--C 1.56 1.351 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -173.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . 0.517 ' HA ' ' OD2' ' A' ' 495' ' ' ASP . 25.7 m -53.68 105.74 0.15 Allowed 'General case' 0 C--O 1.249 1.059 0 C-N-CA 124.35 1.06 . . . . 0.0 113.639 -173.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -124.4 125.01 43.57 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 177.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -59.86 -9.04 2.53 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -171.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . 0.454 ' HB2' HD22 ' A' ' 535' ' ' LEU . 8.8 t-80 -58.97 -49.54 77.49 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 172.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -63.95 -38.16 90.06 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.863 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -63.44 -50.24 70.53 Favored 'General case' 0 CA--C 1.501 -0.914 0 O-C-N 123.612 0.57 . . . . 0.0 109.63 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.448 ' O ' HG23 ' A' ' 510' ' ' VAL . 14.7 m-85 -56.61 -46.01 81.14 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.367 -178.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . 0.535 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 21.6 t -73.84 -46.37 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.541 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.844 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -51.72 -43.04 62.69 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 117.956 0.344 . . . . 0.0 111.647 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -57.09 -50.18 73.58 Favored 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 123.922 0.764 . . . . 0.0 109.135 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 506' ' ' TYR . 48.6 t -61.1 -51.12 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.666 175.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 95.5 mt -53.04 -51.03 63.06 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.763 -175.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -71.36 -32.7 68.81 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.977 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -66.74 -49.91 64.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.888 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . 0.416 ' CD2' HG12 ' A' ' 510' ' ' VAL 0.282 1.0 OUTLIER -71.3 -26.53 62.9 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.28 177.312 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . 0.653 ' HA ' ' HB3' ' A' ' 519' ' ' ASP . 23.4 t80 -52.16 -41.17 62.37 Favored 'General case' 0 C--N 1.347 0.475 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 175.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -72.19 -15.06 61.95 Favored 'General case' 0 CA--C 1.555 1.153 0 CA-C-N 114.189 -1.368 . . . . 0.0 114.015 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -120.92 -57.25 1.89 Allowed 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -172.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -153.48 105.28 2.82 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 103.901 -2.629 . . . . 0.0 103.901 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . 0.653 ' HB3' ' HA ' ' A' ' 515' ' ' TYR . 8.0 p-10 -106.01 91.35 3.7 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 117.341 2.349 . . . . 0.0 117.341 -165.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . 0.458 ' OE1' ' HG2' ' A' ' 482' ' ' ARG . 25.2 mt-30 -145.06 158.45 43.81 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 126.707 2.003 . . . . 0.0 106.389 158.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -80.52 124.49 28.99 Favored 'General case' 0 N--CA 1.424 -1.747 0 CA-C-N 119.958 1.253 . . . . 0.0 108.668 176.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -107.68 148.31 29.55 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 42.2 pt -83.14 -14.98 11.75 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 122.951 0.5 . . . . 0.0 111.233 -175.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.617 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 42.4 p -57.16 -41.42 79.18 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.415 0.626 . . . . 0.0 109.501 176.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . 0.419 ' CG ' HG11 ' A' ' 510' ' ' VAL . 24.5 t70 -58.26 -49.62 76.47 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.17 177.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.404 ' HA ' ' HD2' ' A' ' 536' ' ' ARG . . . -59.83 -49.01 79.38 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.256 -178.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.627 ' O ' HG12 ' A' ' 530' ' ' VAL . 7.8 p -65.99 -29.29 46.37 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . 0.617 ' HG3' ' O ' ' A' ' 524' ' ' SER . 94.2 mt-30 -67.57 -43.5 80.44 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.751 0.786 . . . . 0.0 109.089 175.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.408 ' HB2' ' HG2' ' A' ' 536' ' ' ARG . 27.4 m-85 -78.59 4.51 13.29 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.627 HG12 ' O ' ' A' ' 527' ' ' VAL . 8.8 p -83.02 -2.4 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.977 -176.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -105.06 -15.23 15.15 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.415 1.103 . . . . 0.0 108.544 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . 0.411 ' C ' ' H ' ' A' ' 534' ' ' GLU . 37.0 t -95.99 -143.16 0.27 Allowed 'General case' 0 C--N 1.296 -1.754 0 C-N-CA 127.574 2.35 . . . . 0.0 108.821 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . 0.49 ' O ' ' N ' ' A' ' 535' ' ' LEU . 7.8 p30 -29.97 30.05 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.363 1 C-N-CA 137.252 6.221 . . . . 0.0 116.916 171.515 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . 0.424 ' C ' ' H ' ' A' ' 537' ' ' GLU . 10.0 pt-20 -30.83 10.67 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.708 1 C-N-CA 133.034 4.534 . . . . 0.0 117.962 -173.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.524 ' H ' HD12 ' A' ' 535' ' ' LEU . 4.3 mp -69.41 -23.92 63.78 Favored 'General case' 0 C--N 1.278 -2.514 0 N-CA-C 102.566 -3.124 . . . . 0.0 102.566 160.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.471 ' O ' HG12 ' A' ' 540' ' ' ILE . 5.6 tpp180 -68.24 -29.44 68.25 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 112.214 -2.266 . . . . 0.0 110.274 171.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . 0.424 ' H ' ' C ' ' A' ' 534' ' ' GLU . 2.2 tm-20 -71.77 -40.14 69.49 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 -178.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.412 ' O ' ' HB2' ' A' ' 541' ' ' SER . 24.4 m -58.69 -43.4 89.96 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 170.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . 0.433 HD11 ' HB2' ' A' ' 478' ' ' LYS . 22.6 tp -59.72 -36.5 76.68 Favored 'General case' 0 CA--C 1.56 1.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.762 177.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 536' ' ' ARG . 35.3 mm -64.03 -37.96 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.506 0.722 . . . . 0.0 109.974 176.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 538' ' ' THR . 21.5 m -56.81 -39.11 73.55 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 121.122 0.487 . . . . 0.0 110.22 174.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' A' ' 475' ' ' ALA . 9.5 mp -66.51 -30.31 70.6 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.408 175.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -65.04 -45.13 86.7 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 175.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -75.59 45.99 0.34 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.195 174.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -50.86 136.57 22.22 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 125.024 1.33 . . . . 0.0 110.084 -177.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . 0.424 ' C ' ' H ' ' A' ' 548' ' ' ASN . 12.2 t30 -83.75 179.67 7.53 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.942 -172.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.492 ' C ' ' H ' ' A' ' 549' ' ' ASP . 3.1 mm? -70.01 23.63 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.317 1.847 . . . . 0.0 113.851 -174.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . 0.424 ' H ' ' C ' ' A' ' 546' ' ' ASN . 17.4 m120 -75.45 24.75 0.11 Allowed 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 127.095 2.158 . . . . 0.0 110.208 174.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . 0.492 ' H ' ' C ' ' A' ' 547' ' ' LEU . 11.0 m-20 -58.88 32.72 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 127.97 2.508 . . . . 0.0 117.493 -172.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -74.68 160.05 81.86 Favored Pre-proline 0 C--N 1.3 -1.563 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -37.4 130.36 0.66 Allowed 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 123.562 2.841 . . . . 0.0 111.233 178.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . 0.412 ' HB2' ' CE1' ' A' ' 479' ' ' HIS . 31.3 p90 -73.37 -6.98 49.68 Favored 'General case' 0 CA--C 1.495 -1.155 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -167.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 59.0 mp0 -71.36 -1.08 11.73 Favored 'General case' 0 C--N 1.291 -1.944 0 C-N-CA 124.256 1.023 . . . . 0.0 111.527 174.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -62.73 -21.57 65.9 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 123.827 0.851 . . . . 0.0 108.887 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . 0.476 ' HG3' HG13 ' A' ' 556' ' ' ILE . 13.5 pt-20 -48.27 -62.96 1.22 Allowed 'General case' 0 C--O 1.215 -0.763 0 C-N-CA 124.58 1.152 . . . . 0.0 113.93 -177.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . 0.476 HG13 ' HG3' ' A' ' 555' ' ' GLU . 16.8 mt -66.39 -36.78 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-O 120.87 0.367 . . . . 0.0 110.14 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -56.98 -52.02 66.89 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.787 177.417 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 562' ' ' VAL . 32.8 t70 -66.94 -49.97 63.82 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.278 178.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -49.75 -53.57 24.18 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.17 1.788 . . . . 0.0 111.655 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 65.4 t -63.21 -47.93 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.625 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -60.14 -41.61 93.07 Favored 'General case' 0 C--O 1.201 -1.458 0 O-C-N 123.069 0.231 . . . . 0.0 111.275 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 558' ' ' ASP . 69.9 t -62.74 -37.3 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-O 121.403 0.62 . . . . 0.0 111.708 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.458 ' HA ' ' CG ' ' A' ' 469' ' ' GLN . 54.6 mt -87.24 -39.8 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.916 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.306 -173.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -81.93 -14.98 55.34 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.01 -174.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -71.95 -13.06 61.53 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.47 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . 0.535 ' HB2' ' NE2' ' A' ' 469' ' ' GLN . 63.0 tttm . . . . . 0 N--CA 1.466 0.36 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.612 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.6 mm? . . . . . 0 N--CA 1.412 -2.327 0 N-CA-C 108.657 -0.868 . . . . 0.0 108.657 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.8 m -57.04 107.37 0.4 Allowed 'General case' 0 C--N 1.289 -2.036 0 O-C-N 124.278 0.986 . . . . 0.0 113.012 -174.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 4.9 ptm85 -65.2 -22.89 66.95 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 177.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.68 ' NE2' ' HB3' ' A' ' 566' ' ' LYS . 97.4 mt-30 -66.3 -32.15 73.38 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 174.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.645 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 3.2 tm-20 -71.24 -28.47 64.2 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.41 ' HA ' ' CD ' ' A' ' 474' ' ' ARG . 12.8 tmtt? -66.69 -35.42 80.1 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.513 176.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.47 99.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.157 0.504 . . . . 0.0 109.72 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -66.35 -35.6 80.75 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.92 177.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.645 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 90.8 mtt180 -57.24 -43.29 82.78 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 175.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . 0.467 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -66.19 -48.36 70.93 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.477 178.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.94 -8.31 6.91 Favored 'General case' 0 C--O 1.25 1.129 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 178.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.681 ' O ' ' HG ' ' A' ' 480' ' ' LEU . 1.0 OUTLIER -55.83 -27.87 53.52 Favored 'General case' 0 C--O 1.21 -1.025 0 O-C-N 122.053 -0.404 . . . . 0.0 111.314 174.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 47.8 pttt -56.83 -7.96 0.53 Allowed 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 124.486 1.114 . . . . 0.0 112.495 176.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.552 ' CD2' ' HA ' ' A' ' 487' ' ' PHE . 24.1 p-80 -52.95 -31.24 39.38 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.312 1.045 . . . . 0.0 110.335 177.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.681 ' HG ' ' O ' ' A' ' 477' ' ' LEU . 1.9 pp -71.99 5.75 2.5 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.524 1.129 . . . . 0.0 113.221 -173.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 92.8 mmm -94.38 -27.57 15.99 Favored 'General case' 0 N--CA 1.42 -1.954 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.014 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . 0.588 ' HB3' ' OG1' ' A' ' 486' ' ' THR . 40.0 ttt180 -78.18 -98.57 0.02 OUTLIER 'General case' 0 C--N 1.367 1.338 0 C-N-CA 117.79 -1.564 . . . . 0.0 109.71 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -145.35 -94.65 0.1 Allowed 'General case' 0 C--N 1.385 2.14 0 C-N-CA 113.462 -3.295 . . . . 0.0 117.752 161.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -101.2 -43.75 5.89 Favored 'General case' 0 CA--C 1.482 -1.664 0 CA-C-O 122.718 1.247 . . . . 0.0 112.183 174.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' A' ' 489' ' ' ASN . 5.8 p-10 -54.16 -43.19 70.41 Favored 'General case' 0 CA--C 1.483 -1.602 0 CA-C-N 112.507 -2.133 . . . . 0.0 109.911 -175.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.588 ' OG1' ' HB3' ' A' ' 482' ' ' ARG . 2.7 m -67.4 -35.34 79.1 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.336 -174.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . 0.552 ' HA ' ' CD2' ' A' ' 479' ' ' HIS . 49.1 t80 -62.59 -55.67 25.02 Favored 'General case' 0 CA--C 1.496 -1.113 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.897 178.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 2.0 tp -75.63 -22.98 56.34 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.809 -176.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 485' ' ' ASP . 5.4 t30 -63.23 -47.01 84.27 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -176.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.33 -32.8 24.1 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.163 -1.015 . . . . 0.0 111.53 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -69.93 -38.02 76.09 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 123.408 0.683 . . . . 0.0 112.16 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -79.93 -30.16 39.88 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 120.906 0.384 . . . . 0.0 110.981 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 36.5 m -77.99 -40.41 39.23 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.577 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.8 t -99.72 100.02 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 CA-C-O 121.859 0.838 . . . . 0.0 109.436 -177.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -87.09 21.06 2.45 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.556 -176.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.453 ' NZ ' ' HB3' ' A' ' 496' ' ' LYS . 1.5 ttpm? -90.13 18.02 6.36 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -64.03 -20.44 65.92 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 124.79 1.236 . . . . 0.0 113.953 -171.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -82.33 -21.49 35.99 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.32 0.581 . . . . 0.0 110.492 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -79.79 -25.45 40.91 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.08 -179.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 3.3 m -67.3 140.03 57.29 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.91 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.03 175.75 2.99 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 124.841 1.256 . . . . 0.0 112.54 -176.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . 0.434 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -57.42 -19.69 25.22 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.626 1.17 . . . . 0.0 112.261 -178.211 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . 0.462 ' O ' HG23 ' A' ' 507' ' ' VAL . 17.1 t-160 -55.97 -40.01 72.64 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 125.146 1.378 . . . . 0.0 109.228 177.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . 0.541 ' O ' ' HD1' ' A' ' 508' ' ' PHE . 55.3 t80 -57.74 -53.16 61.31 Favored 'General case' 0 C--O 1.203 -1.365 0 C-N-CA 125.572 1.549 . . . . 0.0 108.619 177.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.434 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 72.5 tttt -57.93 -43.3 86.18 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 125.771 1.629 . . . . 0.0 111.923 -173.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -61.49 -56.11 23.72 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.49 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . 0.564 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 3.2 t -67.48 -46.99 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.705 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.808 -174.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . 0.541 ' HD1' ' O ' ' A' ' 504' ' ' PHE . 59.2 m-85 -55.3 -34.6 64.29 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 178.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -60.76 -52.43 65.14 Favored 'General case' 0 C--O 1.256 1.41 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 176.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 17.9 t -63.29 -46.26 96.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.898 177.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 93.5 mt -59.76 -49.28 78.34 Favored 'General case' 0 C--O 1.206 -1.198 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.545 -176.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -66.36 -28.7 68.85 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.737 0.303 . . . . 0.0 110.352 -177.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -70.44 -27.75 64.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.194 0.521 . . . . 0.0 110.249 177.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -83.07 -42.42 17.46 Favored 'General case' 0 CA--C 1.481 -1.677 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 175.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -50.24 -24.91 3.17 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.663 1.185 . . . . 0.0 111.349 176.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -52.71 -35.63 56.01 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 173.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -108.81 -61.32 1.63 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 119.62 -0.832 . . . . 0.0 109.482 173.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -159.14 135.71 9.3 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -75.84 97.01 3.8 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 120.47 1.486 . . . . 0.0 108.756 177.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -137.51 94.88 2.98 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.43 -176.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . 0.568 ' CE2' ' HB2' ' A' ' 526' ' ' ALA . 0.1 OUTLIER -58.45 143.63 44.82 Favored 'General case' 0 N--CA 1.401 -2.896 0 CA-C-O 121.604 0.716 . . . . 0.0 112.101 173.715 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -118.45 135.02 54.61 Favored 'General case' 0 C--N 1.285 -2.234 0 N-CA-C 105.14 -2.171 . . . . 0.0 105.14 173.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . 0.426 ' O ' HG12 ' A' ' 527' ' ' VAL . 3.9 tp -53.68 -34.47 24.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 O-C-N 123.659 0.599 . . . . 0.0 112.032 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 28.9 t -55.36 -48.86 73.61 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 122.977 0.511 . . . . 0.0 111.01 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.04 -42.85 99.61 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.89 0.852 . . . . 0.0 110.255 178.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.568 ' HB2' ' CE2' ' A' ' 521' ' ' TYR . . . -58.74 -52.99 63.33 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.788 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.426 HG12 ' O ' ' A' ' 523' ' ' ILE . 14.1 p -70.36 -36.23 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.924 0 C-N-CA 123.366 0.666 . . . . 0.0 111.998 -177.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -71.67 -12.95 61.59 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 121.074 -1.016 . . . . 0.0 110.651 177.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.63 ' HB3' ' HG3' ' A' ' 536' ' ' ARG . 0.0 OUTLIER -76.52 -3.91 39.89 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.991 173.229 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . . . . . . . . . 4.7 p -72.88 22.57 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.573 1.83 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -176.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -70.41 -34.96 73.12 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 121.186 -0.946 . . . . 0.0 108.635 174.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 23.1 t -91.42 111.04 22.37 Favored 'General case' 0 N--CA 1.42 -1.939 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 170.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -61.4 -60.98 2.88 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.098 -174.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -56.31 -46.58 79.78 Favored 'General case' 0 C--O 1.244 0.794 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.62 -174.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.59 -56.5 9.18 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.002 -173.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.63 ' HG3' ' HB3' ' A' ' 529' ' ' TYR . 2.3 mmt180 -72.4 -28.24 62.86 Favored 'General case' 0 N--CA 1.419 -2.018 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.45 -52.44 65.36 Favored 'General case' 0 C--O 1.251 1.174 0 CA-C-N 119.261 0.937 . . . . 0.0 110.002 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 541' ' ' SER . 1.9 p -63.93 -46.08 86.36 Favored 'General case' 0 N--CA 1.425 -1.689 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.284 177.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 19.0 tp -62.82 -32.89 74.18 Favored 'General case' 0 CA--C 1.56 1.341 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . 0.432 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 55.9 mt -66.94 -38.42 81.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 173.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 538' ' ' THR . 50.0 m -57.28 -38.54 74.08 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.047 172.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.615 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 3.9 mm? -71.78 -27.3 62.85 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 173.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -61.83 -56.09 23.11 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 174.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 540' ' ' ILE . 28.1 pt20 -80.21 13.25 2.42 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.665 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . 0.615 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 2.9 t80 -66.26 118.33 9.81 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.655 0.741 . . . . 0.0 110.93 177.524 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -94.03 120.62 34.54 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.714 -175.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.669 ' H ' HD13 ' A' ' 547' ' ' LEU . 0.0 OUTLIER -83.15 7.15 16.89 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -177.228 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -81.93 -21.13 37.46 Favored 'General case' 0 C--N 1.312 -1.049 0 O-C-N 121.304 -0.873 . . . . 0.0 109.799 175.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -69.31 -67.55 0.47 Allowed 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -86.5 111.65 40.9 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 167.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -50.1 146.61 17.13 Favored 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 123.464 2.776 . . . . 0.0 114.579 -170.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -73.97 -2.92 26.12 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 122.145 0.974 . . . . 0.0 111.043 -173.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -81.97 -41.59 20.56 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.518 170.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -73.07 -22.05 60.67 Favored 'General case' 0 C--O 1.185 -2.316 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -24.71 -70.3 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 126.629 1.972 . . . . 0.0 113.428 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 53.2 mt -68.46 -47.88 75.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.82 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -59.29 -48.89 79.92 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.097 -0.956 . . . . 0.0 113.026 -175.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -66.46 -51.39 57.31 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 124.084 0.953 . . . . 0.0 110.638 -177.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -51.58 -52.13 49.88 Favored 'General case' 0 C--O 1.246 0.872 0 C-N-CA 124.157 0.983 . . . . 0.0 110.474 176.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 95.0 t -66.91 -40.16 85.12 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.738 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -58.73 -39.4 80.77 Favored 'General case' 0 C--O 1.196 -1.757 0 C-N-CA 122.993 0.517 . . . . 0.0 110.637 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . 0.434 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 47.2 t -66.32 -36.59 77.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.418 0.628 . . . . 0.0 111.873 177.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.547 ' HA ' ' HG2' ' A' ' 469' ' ' GLN . 49.6 mt -78.67 -43.93 25.68 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 CA-C-O 121.738 0.78 . . . . 0.0 109.678 -177.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -77.94 -6.55 54.75 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.152 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.434 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 29.2 tt0 -61.74 -45.58 93.31 Favored 'General case' 0 CA--C 1.49 -1.346 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 175.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . 0.68 ' HB3' ' NE2' ' A' ' 469' ' ' GLN . 59.4 tttm . . . . . 0 C--N 1.303 -1.449 0 CA-C-O 122.554 1.168 . . . . 0.0 108.129 178.207 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 98.9 mt . . . . . 0 N--CA 1.437 -1.09 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 17.0 m -58.9 136.72 57.95 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 114.021 -1.445 . . . . 0.0 114.298 -171.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -65.83 -32.78 74.5 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.911 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.487 ' HG2' ' HA ' ' A' ' 563' ' ' ILE . 97.3 mt-30 -64.28 -41.85 96.69 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 175.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 5.8 tm-20 -63.34 -29.05 70.42 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.287 178.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.414 ' HD3' ' HA ' ' A' ' 471' ' ' LYS . 25.9 mmtm -66.34 -37.86 86.32 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.555 171.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.44 -36.96 71.44 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.118 -177.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 504' ' ' PHE . 0.9 OUTLIER -57.94 -40.81 81.4 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 123.327 0.392 . . . . 0.0 110.777 171.863 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 93.4 mtt180 -62.37 -42.81 99.7 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 177.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -67.44 -29.88 69.47 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.058 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -66.03 -33.58 76.12 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.68 0.752 . . . . 0.0 109.875 177.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 87.3 mt -76.52 10.57 2.03 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.446 177.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.437 ' HE3' ' CD2' ' A' ' 545' ' ' TYR . 18.9 tptm -59.88 -10.62 4.18 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.433 1.093 . . . . 0.0 112.989 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -74.76 142.03 44.35 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.908 -0.495 . . . . 0.0 111.424 -176.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.733 ' H ' HD13 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -75.66 -150.77 0.03 OUTLIER 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.792 175.252 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . 0.465 ' C ' ' H ' ' A' ' 483' ' ' ASP . 66.8 mtt -50.4 -9.88 0.05 Allowed 'General case' 0 N--CA 1.516 2.851 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 -177.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -72.92 7.12 2.18 Favored 'General case' 0 CA--C 1.561 1.386 0 C-N-CA 125.185 1.394 . . . . 0.0 109.518 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . 0.465 ' H ' ' C ' ' A' ' 481' ' ' MET . 5.5 p-10 -70.41 -10.96 60.52 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 125.701 1.6 . . . . 0.0 113.65 -170.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -63.02 -44.63 95.44 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.738 0.78 . . . . 0.0 109.649 176.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.61 -51.67 66.38 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 114.726 -1.124 . . . . 0.0 109.649 178.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 59.0 m -61.81 -40.64 95.95 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 114.561 -1.199 . . . . 0.0 111.995 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 23.1 t80 -56.57 -53.28 59.4 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 122.394 0.278 . . . . 0.0 110.734 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.437 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 65.8 mt -72.73 -25.46 61.22 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.588 -178.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -69.23 -39.85 78.28 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.636 0.731 . . . . 0.0 110.085 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.79 -21.48 26.47 Favored 'General case' 0 N--CA 1.424 -1.737 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.326 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . 0.549 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.3 OUTLIER -67.03 -41.24 86.94 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 123.801 0.84 . . . . 0.0 109.332 178.878 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 8.9 pt-20 -77.92 -46.32 21.6 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -176.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 27.5 p -89.98 -28.65 18.98 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -170.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 47.0 t -91.2 162.7 2.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 O-C-N 122.012 -0.43 . . . . 0.0 111.187 -170.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -75.09 109.82 8.88 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 121.896 0.855 . . . . 0.0 111.05 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -88.9 -25.02 22.34 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.143 -1.389 . . . . 0.0 108.715 176.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -86.75 -66.57 0.89 Allowed 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 118.845 2.906 . . . . 0.0 118.845 -166.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -107.27 -34.15 7.19 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 118.723 2.86 . . . . 0.0 118.723 -160.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -76.77 -94.97 0.02 OUTLIER 'General case' 0 CA--C 1.566 1.574 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -163.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 19.6 m -129.84 76.08 1.7 Allowed 'General case' 0 C--N 1.314 -0.977 0 O-C-N 120.794 -1.191 . . . . 0.0 109.303 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -130.79 45.87 2.75 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 117.397 2.369 . . . . 0.0 117.397 -170.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -84.85 -33.65 22.8 Favored 'General case' 0 CA--C 1.492 -1.278 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 170.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . 0.561 ' CD2' HD11 ' A' ' 535' ' ' LEU . 45.4 m170 -59.25 -51.68 68.94 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . 0.444 ' CZ ' ' HB3' ' A' ' 473' ' ' GLU . 97.0 m-85 -68.01 -25.76 65.55 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 113.973 -1.467 . . . . 0.0 114.308 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -63.83 -46.83 83.32 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 175.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.583 ' O ' HG23 ' A' ' 510' ' ' VAL . 2.6 t80 -64.37 -32.56 74.23 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.893 -1.049 . . . . 0.0 112.379 174.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.53 -50.4 72.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 173.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -51.98 -43.01 63.38 Favored 'General case' 0 C--N 1.355 0.845 0 CA-C-O 120.899 0.38 . . . . 0.0 110.126 173.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -55.98 -60.11 3.95 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.341 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 506' ' ' TYR . 21.5 t -58.07 -53.58 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 O-C-N 123.57 0.544 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.58 -36.94 85.25 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -174.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -70.06 -32.2 70.18 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.485 -0.486 . . . . 0.0 109.808 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -72.43 -27.69 62.49 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 178.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -67.04 -54.24 23.49 Favored 'General case' 0 CA--C 1.49 -1.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.907 171.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . 0.436 ' HA ' ' HB3' ' A' ' 519' ' ' ASP . 0.4 OUTLIER -49.96 -29.68 8.95 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.801 0.84 . . . . 0.0 112.552 178.333 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -63.77 -36.23 83.21 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.572 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -111.89 -59.41 1.99 Allowed 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.4 -176.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -157.31 118.81 3.69 Favored 'General case' 0 CA--C 1.493 -1.224 0 C-N-CA 125.148 1.379 . . . . 0.0 107.659 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . 0.436 ' HB3' ' HA ' ' A' ' 515' ' ' TYR . 2.2 p-10 -90.95 92.51 8.79 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -175.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -144.4 128.93 18.05 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 126.49 1.916 . . . . 0.0 107.055 162.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -70.32 132.42 45.65 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 119.546 1.066 . . . . 0.0 110.453 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -118.73 135.0 54.73 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 34.5 pt -79.47 -16.21 13.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 122.152 0.977 . . . . 0.0 110.216 -175.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.402 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 5.6 p -60.05 -30.9 69.5 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.258 172.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.73 -39.64 91.34 Favored 'General case' 0 CA--C 1.481 -1.675 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.771 178.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.3 99.59 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.325 -0.95 . . . . 0.0 109.34 175.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.432 ' O ' HG12 ' A' ' 530' ' ' VAL . 61.5 t -61.8 -35.92 70.65 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.375 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.966 175.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.5 mm100 -72.24 -24.24 61.34 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 121.498 -0.751 . . . . 0.0 111.332 176.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.409 ' CE2' HG22 ' A' ' 510' ' ' VAL . 9.2 m-85 -79.64 -23.08 42.82 Favored 'General case' 0 N--CA 1.44 -0.97 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 175.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.432 HG12 ' O ' ' A' ' 527' ' ' VAL 0.369 12.2 p -75.93 55.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.241 0.606 0 CA-C-O 123.062 1.41 . . . . 0.0 114.034 -177.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -105.0 -29.95 10.1 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 104.209 -2.515 . . . . 0.0 104.209 172.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 46.5 m -92.92 161.9 14.29 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 164.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -86.29 -58.43 2.63 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 -176.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.17 -79.64 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 -161.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.561 HD11 ' CD2' ' A' ' 503' ' ' HIS . 2.6 mm? -75.44 -17.27 60.2 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 122.109 0.956 . . . . 0.0 112.132 -172.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -77.84 -46.0 22.72 Favored 'General case' 0 C--N 1.272 -2.799 0 CA-C-N 113.775 -1.557 . . . . 0.0 107.523 -173.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -66.5 -38.32 86.98 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.086 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 32.1 m -57.07 -51.61 68.6 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.709 178.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 27.9 tp -57.7 -45.55 85.52 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 111.323 0.12 . . . . 0.0 111.323 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 78.9 mt -60.18 -37.79 74.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-O 121.424 0.631 . . . . 0.0 110.289 176.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.7 m -57.27 -35.41 69.73 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.474 176.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.31 -43.89 69.41 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.903 0.382 . . . . 0.0 110.218 174.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -60.9 -36.43 79.23 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.09 0.956 . . . . 0.0 113.084 -177.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -72.48 23.81 0.06 Allowed 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . 0.437 ' CD2' ' HE3' ' A' ' 478' ' ' LYS . 50.7 t80 -65.92 147.16 53.8 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -87.59 173.67 8.91 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -173.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.412 ' C ' ' H ' ' A' ' 549' ' ' ASP . 7.7 mp -80.53 21.42 0.64 Allowed 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -174.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 23.2 p-10 -77.02 22.78 0.19 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.197 0.599 . . . . 0.0 111.98 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . 0.412 ' H ' ' C ' ' A' ' 547' ' ' LEU . 23.0 m-20 -63.67 3.84 0.32 Allowed 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 127.148 2.179 . . . . 0.0 115.181 -175.365 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.475 ' HB3' ' HD2' ' A' ' 551' ' ' PRO . 47.0 mt-10 -60.26 151.57 67.19 Favored Pre-proline 0 C--N 1.308 -1.199 0 CA-C-O 118.789 -0.624 . . . . 0.0 109.74 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . 0.475 ' HD2' ' HB3' ' A' ' 550' ' ' GLU . 1.9 Cg_exo 8.99 74.71 0.0 OUTLIER 'Trans proline' 0 C--N 1.379 2.179 1 C-N-CA 126.534 4.823 . . . . 0.0 117.032 -164.339 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 56.0 p90 -84.56 5.0 29.46 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.574 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -73.5 10.4 1.06 Allowed 'General case' 0 C--N 1.288 -2.102 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -176.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 24.1 p-10 -76.04 -21.66 56.56 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 168.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -25.41 -75.38 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 127.322 2.249 . . . . 0.0 113.348 178.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 22.4 pt -61.99 -35.73 70.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 C-N-CA 123.85 0.86 . . . . 0.0 112.432 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.34 -54.11 47.96 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -63.43 -46.34 86.76 Favored 'General case' 0 C--O 1.201 -1.496 0 CA-C-N 113.897 -1.501 . . . . 0.0 110.909 -179.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . 0.597 ' O ' HG12 ' A' ' 563' ' ' ILE . 75.5 t80 -57.77 -53.3 59.72 Favored 'General case' 0 C--N 1.291 -1.94 0 C-N-CA 123.798 0.839 . . . . 0.0 112.009 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 71.6 t -63.55 -46.63 94.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.445 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 64.4 m-20 -60.32 -47.7 84.9 Favored 'General case' 0 C--O 1.175 -2.842 0 CA-C-O 118.151 -0.928 . . . . 0.0 112.149 177.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . 0.49 ' HA ' ' HG2' ' A' ' 565' ' ' GLU . 55.6 t -60.38 -47.87 90.66 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.991 0 CA-C-N 119.271 0.941 . . . . 0.0 111.289 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.597 HG12 ' O ' ' A' ' 559' ' ' TYR . 38.5 mm -66.03 -32.41 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-O 121.543 0.687 . . . . 0.0 110.321 -176.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -92.29 -22.76 19.56 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -175.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.49 ' HG2' ' HA ' ' A' ' 562' ' ' VAL . 6.9 pt-20 -85.24 -28.69 25.2 Favored 'General case' 0 CA--C 1.505 -0.76 0 C-N-CA 119.473 -0.891 . . . . 0.0 109.039 -175.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . 0.474 ' HA ' ' HE3' ' A' ' 566' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--N 1.317 -0.829 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.942 -175.78 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 73.9 mt . . . . . 0 N--CA 1.427 -1.614 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 49.6 m -98.67 105.63 17.8 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -167.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -68.09 -40.13 82.72 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 114.504 -1.225 . . . . 0.0 107.95 171.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -59.0 -32.14 69.42 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 113.517 -1.674 . . . . 0.0 110.856 -178.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.607 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 38.0 tt0 -67.16 -34.97 78.69 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.211 178.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.494 ' O ' ' HD3' ' A' ' 471' ' ' LYS . 2.2 tmtp? -66.66 -41.6 87.95 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -178.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . 0.437 ' HB3' HD11 ' A' ' 563' ' ' ILE . . . -60.06 -41.29 92.05 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.987 177.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 504' ' ' PHE . 0.3 OUTLIER -66.21 -39.41 89.61 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.386 179.629 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.607 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 98.2 mtt180 -55.08 -45.08 75.37 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.152 0.501 . . . . 0.0 109.83 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -68.14 -42.55 79.94 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.03 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -63.02 -52.81 61.45 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.799 -177.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.79 -40.42 92.53 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 124.007 0.817 . . . . 0.0 109.865 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 19.5 tttp -49.17 -70.69 0.08 Allowed 'General case' 0 C--O 1.221 -0.425 0 O-C-N 123.888 0.742 . . . . 0.0 111.994 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . 0.26 16.6 m170 27.97 -100.92 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 115.324 1.602 . . . . 0.0 115.324 -174.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 78.9 mt -166.46 179.95 5.27 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 126.084 1.754 . . . . 0.0 106.762 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 1.4 pmm? -75.93 -8.41 56.85 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.783 0.802 . . . . 0.0 110.293 178.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -63.08 -47.24 83.73 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 124.76 1.224 . . . . 0.0 110.392 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . 0.523 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 3.3 m-20 -71.34 43.71 0.08 Allowed 'General case' 0 C--N 1.285 -2.203 0 C-N-CA 126.647 1.979 . . . . 0.0 115.78 -172.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -67.57 -39.77 84.91 Favored 'General case' 0 C--O 1.247 0.929 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.21 -52.53 65.17 Favored 'General case' 0 C--O 1.205 -1.282 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.242 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.523 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 3.4 m -56.92 -42.73 80.51 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 124.661 1.184 . . . . 0.0 111.22 -177.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . 0.463 ' CE1' ' HE2' ' A' ' 491' ' ' TYR . 84.0 t80 -51.3 -56.61 12.11 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.637 0.775 . . . . 0.0 109.719 175.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 63.7 mt -74.81 -28.3 60.66 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 122.085 -0.384 . . . . 0.0 111.341 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -69.81 -27.12 64.62 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.288 0.566 . . . . 0.0 110.859 -177.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.22 -40.31 19.79 Favored 'General case' 0 N--CA 1.414 -2.233 0 C-N-CA 120.084 -0.646 . . . . 0.0 109.318 177.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . 0.463 ' HE2' ' CE1' ' A' ' 487' ' ' PHE . 42.1 m-85 -58.01 -32.64 68.13 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -77.71 -38.85 46.41 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.607 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 17.8 t -87.23 -39.28 15.58 Favored 'General case' 0 C--O 1.249 1.074 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -173.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 41.9 t -92.97 166.66 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 -175.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -80.27 117.39 21.0 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -67.96 -44.37 76.87 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.078 -176.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.07 -53.86 47.03 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 -169.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -76.69 -35.0 58.17 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.176 -174.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . 0.442 ' CZ ' HG23 ' A' ' 563' ' ' ILE 0.262 37.2 m-85 -78.6 -15.25 58.75 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -178.357 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 57.4 m -77.04 86.91 3.54 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 118.737 -1.185 . . . . 0.0 108.379 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -84.45 -178.2 6.84 Favored 'General case' 0 C--O 1.208 -1.112 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -63.15 -35.38 80.1 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -59.31 -56.92 15.9 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.565 -1.652 . . . . 0.0 108.422 177.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 473' ' ' GLU 0.309 57.6 m-85 -66.73 -26.83 67.19 Favored 'General case' 0 N--CA 1.421 -1.88 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 178.865 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 36.1 tttm -63.0 -47.6 82.41 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 175.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.567 ' O ' HG23 ' A' ' 510' ' ' VAL . 9.2 m-85 -52.51 -60.7 2.92 Favored 'General case' 0 N--CA 1.439 -1.022 0 O-C-N 124.506 1.129 . . . . 0.0 110.937 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . 0.47 HG22 ' HA ' ' A' ' 504' ' ' PHE . 22.7 m -65.45 -44.81 94.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -50.49 -51.83 43.7 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.094 0.557 . . . . 0.0 110.604 176.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -57.74 -51.93 67.52 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.541 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 506' ' ' TYR . 21.8 t -62.42 -47.6 92.26 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 O-C-N 123.475 0.484 . . . . 0.0 111.764 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 3.8 tt -68.2 -41.33 81.53 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.859 -174.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -66.53 -41.98 87.94 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.376 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -64.23 -49.33 72.36 Favored 'General case' 0 CA--C 1.501 -0.907 0 C-N-CA 123.272 0.629 . . . . 0.0 110.763 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -61.63 -46.96 87.54 Favored 'General case' 0 C--O 1.177 -2.738 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.946 177.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . 0.468 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 0.5 OUTLIER -48.29 -39.94 23.32 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.761 0.824 . . . . 0.0 110.0 -179.323 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.15 -56.52 5.92 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.467 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -95.48 -11.06 28.14 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -169.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -150.96 -151.29 0.38 Allowed 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 106.449 -1.686 . . . . 0.0 106.449 -175.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -97.38 -162.95 1.0 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 176.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -83.77 -170.69 3.2 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 118.431 0.56 . . . . 0.0 112.299 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -41.69 118.78 1.15 Allowed 'General case' 0 N--CA 1.418 -2.069 0 N-CA-C 115.559 1.689 . . . . 0.0 115.559 -178.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -107.27 111.55 23.98 Favored 'General case' 0 N--CA 1.415 -2.194 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 172.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 30.7 pt -54.78 -28.04 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.098 1.359 . . . . 0.0 112.901 -174.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 10.2 m -58.51 -31.52 67.96 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.563 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -36.65 77.91 Favored 'General case' 0 C--O 1.245 0.852 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.634 ' HA ' ' CD2' ' A' ' 529' ' ' TYR . . . -61.52 -35.6 78.18 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.04 178.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 52.3 t -67.91 -34.86 69.71 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.496 0 C-N-CA 124.381 1.072 . . . . 0.0 108.996 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -66.44 -20.74 66.13 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.634 ' CD2' ' HA ' ' A' ' 526' ' ' ALA . 18.9 m-85 -74.65 7.14 3.22 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.172 173.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.467 ' HA ' ' CB ' ' A' ' 536' ' ' ARG . 8.1 p -72.9 14.25 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.625 0 CA-C-O 122.334 1.064 . . . . 0.0 110.411 173.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . 0.437 ' H ' ' C ' ' A' ' 529' ' ' TYR . 46.3 m-80 -101.35 -21.18 14.91 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . 0.549 ' OG ' ' HB2' ' A' ' 535' ' ' LEU . 80.9 p -83.91 157.89 21.79 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -63.5 -61.92 2.01 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -94.23 -40.5 9.97 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -173.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.549 ' HB2' ' OG ' ' A' ' 532' ' ' SER . 99.5 mt -62.99 -22.66 67.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -174.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.467 ' CB ' ' HA ' ' A' ' 530' ' ' VAL . 18.0 ptp180 -59.61 -42.84 93.54 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.428 0.632 . . . . 0.0 109.567 177.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -70.53 -56.53 6.33 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.274 -177.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.442 ' O ' HD13 ' A' ' 542' ' ' LEU . 12.9 m -59.12 -53.65 55.92 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.375 -176.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . 0.511 ' HB3' ' HB1' ' A' ' 526' ' ' ALA 0.262 4.4 mm? -61.72 -38.91 89.63 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.232 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . 0.578 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 69.4 mt -69.04 -36.77 75.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.052 176.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 57.5 m -56.17 -43.52 78.46 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.524 0.678 . . . . 0.0 109.617 173.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.442 HD13 ' O ' ' A' ' 538' ' ' THR . 8.8 mp -65.63 -31.23 72.15 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.114 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -70.9 -41.42 71.3 Favored 'General case' 0 C--N 1.317 -0.844 0 O-C-N 122.086 -0.384 . . . . 0.0 110.772 177.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . 0.578 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 76.5 mt-30 -69.9 -27.87 65.15 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.195 -177.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -67.48 118.59 11.02 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 174.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -124.7 130.67 52.85 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -168.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 61.9 tp -75.24 -27.89 59.66 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.956 -178.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -73.17 -36.81 66.67 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.806 -0.357 . . . . 0.0 111.058 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -68.73 -55.25 11.96 Favored 'General case' 0 CA--C 1.508 -0.673 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.382 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.53 114.5 25.26 Favored Pre-proline 0 C--N 1.298 -1.654 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.74 151.74 74.49 Favored 'Trans proline' 0 C--O 1.249 1.041 0 C-N-CA 122.585 2.19 . . . . 0.0 111.333 175.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -126.89 49.86 2.02 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.824 0.821 . . . . 0.0 111.307 -174.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.96 -12.63 60.0 Favored 'General case' 0 C--N 1.285 -2.23 0 CA-C-O 121.667 0.746 . . . . 0.0 112.314 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -79.29 -22.29 44.84 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 124.489 1.116 . . . . 0.0 108.789 173.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -39.07 -69.36 0.13 Allowed 'General case' 0 C--O 1.199 -1.56 0 C-N-CA 125.331 1.453 . . . . 0.0 111.585 -175.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 38.8 pt -54.1 -39.68 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 123.724 0.64 . . . . 0.0 112.193 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.35 -55.01 36.47 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.951 0.9 . . . . 0.0 110.995 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -73.96 -35.89 64.56 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.326 -175.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . 0.647 ' CE1' HD12 ' A' ' 563' ' ' ILE . 93.4 t80 -57.25 -52.74 64.11 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 125.164 1.386 . . . . 0.0 111.648 177.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 14.4 p -64.21 -38.37 82.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 109.811 -0.441 . . . . 0.0 109.811 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.483 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 27.1 t-20 -61.76 -45.41 94.02 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.476 178.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.54 -50.47 34.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -178.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.647 HD12 ' CE1' ' A' ' 559' ' ' TYR . 30.5 mt -95.85 -45.74 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.118 0 CA-C-O 121.793 0.806 . . . . 0.0 111.638 -167.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -81.24 6.75 13.11 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 122.485 1.136 . . . . 0.0 108.076 -175.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 4.2 tm-20 -57.91 -39.12 77.16 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 169.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm . . . . . 0 C--N 1.32 -0.703 0 CA-C-N 113.955 -1.475 . . . . 0.0 113.145 -178.962 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . 0.533 HD12 ' O ' ' A' ' 466' ' ' LEU . 3.2 pp . . . . . 0 N--CA 1.417 -2.091 0 N-CA-C 108.156 -1.053 . . . . 0.0 108.156 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . 0.52 ' HB2' ' OE1' ' A' ' 469' ' ' GLN . 4.0 p -109.64 162.86 14.02 Favored 'General case' 0 C--N 1.279 -2.496 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -176.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . 0.549 ' O ' ' HB2' ' A' ' 471' ' ' LYS . 4.3 ptp180 -64.93 -18.08 64.92 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.252 0.548 . . . . 0.0 112.076 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.52 ' OE1' ' HB2' ' A' ' 467' ' ' SER . 26.3 mp0 -65.15 -27.23 68.57 Favored 'General case' 0 C--N 1.31 -1.122 0 O-C-N 122.072 -0.393 . . . . 0.0 111.922 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.442 ' HA ' ' OE1' ' A' ' 473' ' ' GLU . 2.3 mp0 -67.02 -25.46 66.3 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 120.983 0.421 . . . . 0.0 111.274 173.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.549 ' HB2' ' O ' ' A' ' 468' ' ' ARG . 16.6 mmtp -67.94 -41.1 83.07 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 173.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -65.23 -46.24 81.45 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.368 178.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . 0.579 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 50.1 mt-10 -54.28 -58.46 7.3 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 175.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 41.3 ttt-85 -51.37 -35.26 37.75 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . 0.624 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -62.27 -51.85 66.08 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -63.51 -44.34 94.59 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.71 0.767 . . . . 0.0 112.056 176.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 61.2 mt -73.4 -9.02 58.26 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 -173.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.624 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 24.7 pttm -74.38 -0.6 17.79 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.596 -0.69 . . . . 0.0 112.164 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.411 ' HB2' ' OD1' ' A' ' 483' ' ' ASP . 6.2 p80 -142.75 108.76 5.19 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 124.118 0.967 . . . . 0.0 108.81 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.519 HD13 HD21 ' A' ' 511' ' ' LEU . 93.0 mt -138.04 8.03 2.71 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -172.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 82.9 mtp -94.49 -66.16 0.93 Allowed 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 119.714 -0.795 . . . . 0.0 111.743 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -71.9 -29.15 64.03 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 122.685 1.231 . . . . 0.0 109.862 177.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . 0.537 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 9.3 m-20 -71.11 51.52 0.16 Allowed 'General case' 0 C--N 1.288 -2.091 0 C-N-CA 127.834 2.453 . . . . 0.0 115.424 -172.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -66.19 -39.61 89.83 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -55.26 -46.05 76.12 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-N 114.045 -1.434 . . . . 0.0 109.538 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.537 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 23.5 m -65.53 -40.98 93.55 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 123.494 0.718 . . . . 0.0 111.774 -177.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . 0.406 ' CE2' ' HE1' ' A' ' 491' ' ' TYR . 37.8 t80 -60.49 -47.65 85.23 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.474 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 4.2 mm? -69.05 -31.57 70.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.904 178.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -72.11 -23.82 61.39 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.268 0.556 . . . . 0.0 110.145 177.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -83.48 -23.69 32.09 Favored 'General case' 0 N--CA 1.388 -3.555 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . 0.474 ' HB2' ' O ' ' A' ' 488' ' ' LEU . 28.9 m-85 -62.2 -42.38 99.24 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 167.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -70.84 -44.18 67.0 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.21 -0.905 . . . . 0.0 111.556 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 19.8 m -78.33 -8.87 58.92 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -174.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 87.4 t -122.17 107.83 20.58 Favored 'Isoleucine or valine' 0 C--O 1.249 1.04 0 CA-C-O 121.14 0.495 . . . . 0.0 110.753 -177.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . 0.272 6.9 p30 -150.67 -84.04 0.09 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 178.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.447 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 4.0 mptp? -76.73 -13.91 59.99 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.801 0.81 . . . . 0.0 112.059 -177.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -72.46 23.91 0.05 Allowed 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 125.977 1.711 . . . . 0.0 111.533 173.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . 0.427 ' H ' ' C ' ' A' ' 496' ' ' LYS . 4.2 p-10 -77.72 18.08 0.49 Allowed 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 123.722 0.809 . . . . 0.0 112.092 -176.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . 0.418 ' CE1' ' HD3' ' A' ' 566' ' ' LYS . 23.4 p90 -77.79 -22.56 49.94 Favored 'General case' 0 C--O 1.244 0.809 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 175.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . 0.525 ' HB ' ' CE2' ' A' ' 504' ' ' PHE . 3.9 m -67.48 156.57 36.31 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.088 -1.414 . . . . 0.0 109.56 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.517 ' C ' ' H ' ' A' ' 503' ' ' HIS . 28.4 t-20 -65.72 164.36 14.7 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 124.496 1.118 . . . . 0.0 111.866 -175.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . 0.519 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 7.8 pt20 -58.6 14.32 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 127.201 2.2 . . . . 0.0 113.85 177.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . 0.517 ' H ' ' C ' ' A' ' 501' ' ' ASN . 7.8 t-160 -64.3 -55.47 21.13 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -174.323 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . 0.525 ' CE2' ' HB ' ' A' ' 500' ' ' THR . 0.1 OUTLIER -61.18 -24.18 66.12 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.141 -1.39 . . . . 0.0 114.069 174.824 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.519 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 45.3 tttp -62.14 -52.07 65.31 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.499 ' O ' HG23 ' A' ' 510' ' ' VAL 0.319 2.8 m-85 -69.12 -29.68 67.79 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 178.524 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 503' ' ' HIS . 82.2 t -63.25 -53.7 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.793 175.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -50.09 -53.88 24.23 Favored 'General case' 0 C--O 1.2 -1.536 0 O-C-N 123.166 0.291 . . . . 0.0 111.22 175.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -57.63 -60.05 4.26 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.941 1.46 . . . . 0.0 114.941 -176.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 506' ' ' TYR . 10.9 t -61.81 -43.38 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.478 -176.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.519 HD21 HD13 ' A' ' 480' ' ' LEU . 10.4 mp -66.64 -49.13 67.24 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.753 -177.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -61.74 -46.92 87.54 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 123.358 0.663 . . . . 0.0 110.047 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -55.88 -48.67 75.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.951 0.5 . . . . 0.0 111.722 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -70.82 -45.14 65.12 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.94 -178.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -52.59 -39.59 61.75 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 124.772 1.229 . . . . 0.0 109.434 175.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -64.63 -21.37 66.7 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.046 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -106.55 -56.46 2.19 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 121.056 0.455 . . . . 0.0 111.141 -178.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -117.58 -154.41 0.56 Allowed 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -173.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . 0.422 ' CG ' ' H ' ' A' ' 520' ' ' GLN . 16.9 t70 -87.22 -159.82 0.54 Allowed 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 125.849 1.659 . . . . 0.0 107.984 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . 0.422 ' H ' ' CG ' ' A' ' 519' ' ' ASP . 77.4 mm-40 -79.22 155.28 28.67 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -170.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -41.88 134.2 2.67 Favored 'General case' 0 N--CA 1.407 -2.597 0 C-N-CA 128.025 2.53 . . . . 0.0 116.255 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -118.1 158.49 24.93 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 106.308 -1.738 . . . . 0.0 106.308 173.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 45.3 pt -68.48 -23.37 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-O 121.583 0.706 . . . . 0.0 109.417 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.442 ' HA ' HG12 ' A' ' 527' ' ' VAL . 3.0 m -56.35 -40.06 73.87 Favored 'General case' 0 N--CA 1.417 -2.109 0 C-N-CA 125.166 1.386 . . . . 0.0 110.891 177.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . 0.425 ' O ' ' HB3' ' A' ' 528' ' ' GLN . 15.9 m-20 -68.4 -33.88 75.02 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.328 0.585 . . . . 0.0 110.4 179.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -64.18 -47.89 78.07 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.642 177.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.442 HG12 ' HA ' ' A' ' 524' ' ' SER . 7.6 p -70.86 -18.22 20.72 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.106 0 CA-C-O 121.77 0.795 . . . . 0.0 110.374 176.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . 0.425 ' HB3' ' O ' ' A' ' 525' ' ' ASP . 0.7 OUTLIER -68.17 -31.58 71.23 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 172.58 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.63 ' HB3' ' HG3' ' A' ' 536' ' ' ARG . 0.5 OUTLIER -85.21 11.38 10.07 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.764 175.223 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.56 ' HA ' ' CZ ' ' A' ' 536' ' ' ARG . 2.9 p -72.94 4.98 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -171.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -109.0 -35.99 6.2 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 119.948 -1.72 . . . . 0.0 110.749 176.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . 0.589 ' O ' ' HG3' ' A' ' 534' ' ' GLU . 24.5 t -80.44 -145.2 0.05 OUTLIER 'General case' 0 CA--C 1.583 2.221 0 CA-C-N 114.474 -1.239 . . . . 0.0 110.342 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . 0.465 ' O ' ' N ' ' A' ' 535' ' ' LEU 0.574 5.3 t-20 -25.34 39.02 0.0 OUTLIER 'General case' 0 CA--C 1.465 -2.325 1 C-N-CA 137.084 6.154 . . . . 0.0 121.61 179.905 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . 0.746 ' HA ' ' HD3' ' A' ' 536' ' ' ARG . 45.9 mt-10 -28.97 6.41 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.813 0 C-N-CA 129.19 2.996 . . . . 0.0 117.384 -177.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.465 ' N ' ' O ' ' A' ' 533' ' ' ASN . 1.0 OUTLIER -72.06 -21.48 61.51 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 162.411 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.746 ' HD3' ' HA ' ' A' ' 534' ' ' GLU . 0.0 OUTLIER -69.59 -18.26 63.6 Favored 'General case' 0 C--N 1.383 2.052 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 172.222 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . 0.51 ' N ' ' HD3' ' A' ' 536' ' ' ARG . 6.1 tp10 -76.95 -41.26 43.96 Favored 'General case' 0 CA--C 1.47 -2.117 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 -178.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.459 ' O ' HD13 ' A' ' 542' ' ' LEU . 27.6 m -54.96 -47.64 74.26 Favored 'General case' 0 N--CA 1.442 -0.873 0 O-C-N 124.05 0.844 . . . . 0.0 108.849 172.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 59.5 tp -56.48 -48.18 77.68 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.267 177.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 536' ' ' ARG . 57.5 mt -63.72 -41.08 91.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-O 120.744 0.307 . . . . 0.0 110.729 178.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.2 m -56.99 -46.44 82.24 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.684 0.754 . . . . 0.0 109.993 174.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 538' ' ' THR . 6.0 mp -67.53 -16.15 64.04 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 124.43 1.092 . . . . 0.0 112.652 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -88.26 -39.85 14.11 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 177.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -67.09 -36.78 82.71 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -68.27 129.18 39.16 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 170.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -74.95 109.06 8.09 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 122.382 1.087 . . . . 0.0 112.189 -168.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 547' ' ' LEU . 1.0 OUTLIER -78.96 -13.93 59.51 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 113.3 -1.773 . . . . 0.0 113.505 -177.215 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -75.94 -6.98 53.48 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.114 0.483 . . . . 0.0 110.666 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -72.59 -8.33 54.67 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.888 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -87.69 149.02 45.25 Favored Pre-proline 0 C--N 1.312 -1.054 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . 0.42 ' O ' ' HB2' ' A' ' 554' ' ' ASN . 23.2 Cg_exo -66.84 129.43 20.87 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.035 1.823 . . . . 0.0 107.99 172.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 555' ' ' GLU . 21.6 t80 -82.84 -6.09 59.28 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 121.937 0.875 . . . . 0.0 111.23 -172.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -82.88 -8.63 59.56 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-O 121.773 0.797 . . . . 0.0 111.502 172.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 551' ' ' PRO . 6.6 m-20 -73.04 -22.89 60.55 Favored 'General case' 0 C--O 1.198 -1.622 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.357 177.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 552' ' ' TYR . 18.6 mm-40 -40.0 -83.65 0.01 OUTLIER 'General case' 0 C--O 1.196 -1.73 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -164.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . 0.473 ' H ' HD12 ' A' ' 556' ' ' ILE . 0.6 OUTLIER -67.59 -39.27 82.0 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-O 121.573 0.701 . . . . 0.0 110.037 -176.722 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.88 -59.81 4.85 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.341 -173.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -73.83 -39.25 64.17 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.147 -176.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . 0.516 ' O ' HG13 ' A' ' 563' ' ' ILE . 93.5 t80 -50.34 -53.34 29.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.257 1.023 . . . . 0.0 111.018 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.4 t -64.69 -40.35 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.768 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.446 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 2.4 t-20 -59.04 -45.92 89.52 Favored 'General case' 0 C--O 1.194 -1.833 0 CA-C-O 119.331 -0.366 . . . . 0.0 110.58 175.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . 0.499 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 91.2 t -66.17 -33.15 61.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 559' ' ' TYR . 14.4 mt -87.09 -31.74 6.12 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.983 0 C-N-CA 118.205 -1.398 . . . . 0.0 108.907 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 78.5 m-20 -83.53 -2.25 55.56 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.638 176.477 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.499 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 11.4 tp10 -73.6 -11.17 60.34 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 113.761 -1.563 . . . . 0.0 107.462 175.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . 0.418 ' HD3' ' CE1' ' A' ' 499' ' ' PHE . 38.4 ttpt . . . . . 0 CA--C 1.533 0.318 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.047 172.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 89.8 mt . . . . . 0 N--CA 1.432 -1.329 0 CA-C-O 120.938 0.399 . . . . 0.0 110.763 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 37.0 t -88.95 106.57 18.5 Favored 'General case' 0 N--CA 1.421 -1.906 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -66.96 -36.93 83.31 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.432 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -68.23 -45.11 74.17 Favored 'General case' 0 C--O 1.198 -1.644 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.743 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -66.26 -22.85 66.32 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -177.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.408 ' HD3' ' C ' ' A' ' 471' ' ' LYS . 10.1 tmtt? -76.9 -37.39 55.54 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 172.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . 0.578 ' HB3' HD11 ' A' ' 563' ' ' ILE . . . -64.22 -51.82 61.81 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.31 178.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . 0.569 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 2.2 mp0 -53.42 -43.1 67.71 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 118.079 0.4 . . . . 0.0 110.961 176.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 61.5 mtt85 -53.82 -41.95 67.91 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 120.853 0.359 . . . . 0.0 111.183 172.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' A' ' 478' ' ' LYS . . . -71.23 -28.56 64.28 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 122.965 0.506 . . . . 0.0 112.317 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -35.06 79.68 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.663 -0.648 . . . . 0.0 110.171 176.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 45.9 mt -64.05 -8.99 13.56 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 124.61 1.164 . . . . 0.0 112.178 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.477 ' HB3' ' O ' ' A' ' 475' ' ' ALA . 80.3 tttt -71.31 -3.96 23.44 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.656 1.582 . . . . 0.0 111.804 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.488 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 16.9 m170 -96.58 152.47 18.61 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 7.9 mp -122.34 -63.99 1.24 Allowed 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 64.0 mtt -95.21 -57.39 2.43 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -171.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -67.77 -12.7 61.11 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . 0.488 ' HB2' ' HB3' ' A' ' 479' ' ' HIS . 26.2 t70 -75.07 8.36 2.64 Favored 'General case' 0 C--O 1.184 -2.379 0 C-N-CA 124.572 1.149 . . . . 0.0 113.13 -175.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -46.72 -61.81 1.67 Allowed 'General case' 0 C--O 1.275 2.395 0 C-N-CA 124.113 0.965 . . . . 0.0 112.682 -174.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -62.84 -43.14 99.59 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.631 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 28.1 m -60.81 -41.79 96.37 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.468 -177.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . 0.517 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 39.0 t80 -59.7 -47.12 86.9 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 123.061 0.544 . . . . 0.0 109.843 175.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 70.9 mt -66.04 -34.55 78.34 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.463 0.649 . . . . 0.0 110.533 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -67.15 -49.11 65.94 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.711 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . 0.496 ' CZ ' ' HE1' ' A' ' 559' ' ' TYR . 1.3 m-85 -76.96 -8.64 57.74 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . 0.517 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.4 OUTLIER -74.55 -52.39 12.0 Favored 'General case' 0 C--N 1.286 -2.185 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.689 176.348 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.17 -27.86 38.9 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -174.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 19.7 p -81.67 -24.42 36.29 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -176.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 50.6 t -96.68 156.24 3.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.086 0.47 . . . . 0.0 110.445 -175.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -85.91 124.44 32.38 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -176.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.56 ' HA ' ' OG1' ' A' ' 500' ' ' THR . 62.3 pttt -88.75 -15.82 33.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.13 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -69.6 -70.93 0.25 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -175.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -106.9 -31.74 8.21 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.502 -174.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -72.66 -37.35 67.97 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.67 -175.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . 0.56 ' OG1' ' HA ' ' A' ' 496' ' ' LYS . 76.1 m -71.66 102.45 2.78 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.887 0.851 . . . . 0.0 112.496 -179.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -77.13 163.16 26.85 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.32 -1.309 . . . . 0.0 107.773 174.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -53.97 -34.84 60.89 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.966 0.803 . . . . 0.0 110.566 179.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -57.15 -56.11 25.97 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.981 175.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -66.13 -30.53 71.04 Favored 'General case' 0 CA--C 1.556 1.195 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.736 -178.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -67.3 -47.71 69.77 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 124.12 0.968 . . . . 0.0 110.072 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.558 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -59.74 -45.91 90.75 Favored 'General case' 0 N--CA 1.425 -1.694 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.869 -178.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 11.8 p -68.28 -40.96 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 O-C-N 123.428 0.455 . . . . 0.0 111.049 -176.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -51.28 -53.92 31.0 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.079 0.466 . . . . 0.0 110.558 173.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.37 -41.85 98.95 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.992 -1.004 . . . . 0.0 113.521 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 506' ' ' TYR . 95.7 t -57.55 -52.45 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 CA-C-O 120.889 0.376 . . . . 0.0 110.814 176.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.5 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 10.2 mp -66.37 -38.69 88.13 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.949 -177.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -62.99 -49.2 75.61 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.629 0.58 . . . . 0.0 109.555 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -52.64 -51.29 60.73 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.677 0.791 . . . . 0.0 110.75 -179.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -64.11 -53.36 50.87 Favored 'General case' 0 C--O 1.187 -2.223 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.747 177.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . 0.5 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 3.6 t80 -52.0 -35.7 47.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.976 0.91 . . . . 0.0 110.968 -177.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.41 -25.26 62.26 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -117.28 -38.2 3.39 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.778 0.799 . . . . 0.0 111.951 -177.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -124.82 -153.09 0.54 Allowed 'General case' 0 C--N 1.285 -2.233 0 C-N-CA 124.802 1.241 . . . . 0.0 109.16 -171.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -85.2 -162.01 0.66 Allowed 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . 0.463 ' HG2' ' H ' ' A' ' 521' ' ' TYR . 8.3 tt0 -82.36 -169.74 2.58 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -177.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . 0.463 ' H ' ' HG2' ' A' ' 520' ' ' GLN . 13.0 t80 -45.43 130.78 8.52 Favored 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 125.48 1.512 . . . . 0.0 114.266 -174.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -118.14 134.41 55.03 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 178.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 1.7 tt -53.72 -26.26 13.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 125.441 1.496 . . . . 0.0 112.029 179.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 48.1 t -54.34 -38.61 66.23 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 122.749 0.42 . . . . 0.0 111.548 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . 0.53 ' O ' ' HB3' ' A' ' 528' ' ' GLN . 2.8 t70 -72.04 -36.91 69.77 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -58.13 -55.53 33.77 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.132 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.445 ' O ' HG12 ' A' ' 530' ' ' VAL . 14.7 p -66.98 -18.84 24.84 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 CA-C-O 121.498 0.666 . . . . 0.0 111.423 179.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . 0.53 ' HB3' ' O ' ' A' ' 525' ' ' ASP . 48.1 tt0 -65.8 -37.75 87.1 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 171.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.444 ' C ' ' H ' ' A' ' 531' ' ' ASN . 76.8 m-85 -79.8 9.48 5.16 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 176.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 527' ' ' VAL . 5.3 p -74.3 16.84 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 CA-C-O 122.413 1.102 . . . . 0.0 110.794 178.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . 0.444 ' H ' ' C ' ' A' ' 529' ' ' TYR . 91.2 m-20 -111.03 -29.57 7.84 Favored 'General case' 0 C--N 1.288 -2.079 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.021 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 12.9 m -81.2 158.52 24.86 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.696 -177.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . 0.48 ' O ' ' HG3' ' A' ' 537' ' ' GLU . 7.8 t30 -65.97 -73.55 0.13 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -177.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -71.93 -32.33 67.23 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -172.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.409 ' H ' HD22 ' A' ' 535' ' ' LEU . 2.5 mm? -66.08 -38.53 88.52 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -178.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 11.6 ttm180 -64.4 -56.41 14.48 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 175.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 533' ' ' ASN . 42.4 mt-10 -55.83 -70.19 0.12 Allowed 'General case' 0 C--N 1.347 0.468 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.186 -177.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 8.9 m -64.31 -54.56 31.15 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -172.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 48.8 tp -63.99 -44.27 93.18 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.013 -173.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . 0.586 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 64.8 mt -69.27 -28.23 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.728 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . 0.47 ' HB2' ' O ' ' A' ' 537' ' ' GLU . 9.0 t -57.43 -44.32 84.57 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 174.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.515 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 3.1 mm? -67.47 -23.53 65.51 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 176.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . 0.45 ' C ' ' H ' ' A' ' 545' ' ' TYR . 36.6 tt0 -76.63 -26.61 55.1 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 121.349 0.595 . . . . 0.0 109.773 174.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . 0.586 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 86.2 mt-30 -80.87 31.86 0.31 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 124.11 0.964 . . . . 0.0 110.368 177.268 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . 0.515 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 6.3 p90 -68.09 166.92 15.04 Favored 'General case' 0 N--CA 1.394 -3.27 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.792 -175.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -79.22 156.0 28.35 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 121.688 0.756 . . . . 0.0 112.304 -170.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' A' ' 549' ' ' ASP . 3.0 mm? -77.23 6.04 7.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.102 -177.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -79.39 21.9 0.46 Allowed 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 125.162 1.385 . . . . 0.0 110.072 177.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 547' ' ' LEU . 3.2 p-10 -67.36 0.5 2.85 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -172.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -61.96 140.65 95.73 Favored Pre-proline 0 C--N 1.324 -0.528 0 N-CA-C 104.905 -2.257 . . . . 0.0 104.905 170.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -0.64 66.34 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.094 1 C-N-CA 126.555 4.836 . . . . 0.0 115.532 -167.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -89.89 19.98 4.47 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 122.921 1.343 . . . . 0.0 109.76 -171.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . 0.418 ' H ' ' HG2' ' A' ' 553' ' ' GLU . 8.7 pt-20 -71.97 -4.6 29.44 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-N 113.577 -1.647 . . . . 0.0 110.854 177.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . 0.613 ' HA ' ' OD2' ' A' ' 557' ' ' ASP . 14.2 m120 -66.56 -23.07 66.16 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.29 172.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.01 -34.06 72.83 Favored 'General case' 0 C--O 1.21 -1.002 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 175.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 57.0 mt -76.45 -39.92 34.07 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.052 0 C-N-CA 124.123 0.969 . . . . 0.0 109.015 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . 0.613 ' OD2' ' HA ' ' A' ' 554' ' ' ASN . 20.1 m-20 -54.82 -54.15 46.02 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-O 121.759 0.79 . . . . 0.0 108.908 174.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.21 -50.66 70.62 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 113.538 -1.665 . . . . 0.0 109.564 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . 0.619 ' O ' HG12 ' A' ' 563' ' ' ILE . 52.5 t80 -56.14 -55.07 37.57 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 124.721 1.208 . . . . 0.0 111.304 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 75.6 t -64.97 -37.26 79.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.032 -174.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.4 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 4.1 t-20 -61.43 -41.04 96.55 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 176.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . 0.597 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 78.1 t -72.46 -40.47 63.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 C-N-CA 123.859 0.864 . . . . 0.0 113.175 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.619 HG12 ' O ' ' A' ' 559' ' ' TYR . 28.5 mm -89.02 -49.02 14.41 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.906 0 CA-C-O 122.03 0.919 . . . . 0.0 109.519 -170.031 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -77.49 3.5 13.32 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.559 -175.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 6.0 pt-20 -75.47 -23.18 56.82 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 174.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 87.8 tttt . . . . . 0 CA--C 1.548 0.876 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.421 178.236 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . 0.406 HD13 HH22 ' A' ' 474' ' ' ARG . 65.6 mt . . . . . 0 N--CA 1.433 -1.281 0 CA-C-O 120.8 0.333 . . . . 0.0 110.384 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 27.3 p -86.84 160.25 18.81 Favored 'General case' 0 C--N 1.292 -1.902 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.994 -177.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -64.11 -29.17 70.31 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.305 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -66.79 -44.43 81.33 Favored 'General case' 0 C--O 1.19 -2.029 0 O-C-N 123.293 0.37 . . . . 0.0 110.32 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.572 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 1.1 tm-20 -62.65 -28.67 70.08 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-O 121.348 0.594 . . . . 0.0 109.639 -178.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.566 ' O ' ' HD3' ' A' ' 471' ' ' LYS . 0.9 OUTLIER -71.2 -35.54 71.6 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 175.033 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -60.52 -48.94 79.56 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . 0.566 ' HB3' ' CD2' ' A' ' 504' ' ' PHE . 1.7 mp0 -58.54 -39.93 81.59 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 121.146 0.498 . . . . 0.0 110.722 175.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.572 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 93.8 mtt180 -62.23 -35.34 78.61 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.22 176.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -66.26 -38.12 87.1 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.651 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . 0.485 ' O ' HD12 ' A' ' 480' ' ' LEU . 1.3 m-85 -65.83 -26.73 67.8 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 174.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 95.1 mt -82.66 -17.08 45.83 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 175.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -40.95 -65.13 0.46 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -168.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.485 ' HA ' ' SD ' ' A' ' 481' ' ' MET . 5.7 t-80 -147.57 36.68 0.89 Allowed 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.131 -1.028 . . . . 0.0 108.869 -174.046 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.495 HD13 HG21 ' A' ' 486' ' ' THR . 84.0 mt -115.89 29.57 7.9 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.222 -174.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . 0.485 ' SD ' ' HA ' ' A' ' 479' ' ' HIS . 2.1 mpp? -76.07 -38.31 57.2 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.759 -176.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -67.82 -48.2 66.89 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-O 121.912 0.863 . . . . 0.0 110.126 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . 0.432 9.0 p-10 -74.51 60.49 0.88 Allowed 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . 0.489 ' HB2' ' CE2' ' A' ' 515' ' ' TYR . 19.5 ptpt -40.83 -30.97 0.14 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.144 2.178 . . . . 0.0 112.858 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -52.17 -50.19 62.3 Favored 'General case' 0 CA--C 1.504 -0.804 0 C-N-CA 124.796 1.238 . . . . 0.0 108.94 176.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.495 HG21 HD13 ' A' ' 480' ' ' LEU . 31.6 m -64.28 -35.88 82.27 Favored 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 125.324 1.45 . . . . 0.0 111.968 -177.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -59.32 -53.13 61.7 Favored 'General case' 0 C--O 1.258 1.506 0 CA-C-O 121.76 0.79 . . . . 0.0 109.151 177.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.515 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 4.0 mm? -72.2 -25.06 61.52 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.908 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -65.26 -33.15 75.3 Favored 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 122.982 0.176 . . . . 0.0 110.604 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.79 -33.95 40.07 Favored 'General case' 0 N--CA 1.385 -3.679 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -66.47 -27.33 67.72 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 120.1 -0.64 . . . . 0.0 112.4 173.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 14.4 mm-40 -78.51 -28.28 46.25 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.083 0.468 . . . . 0.0 110.967 175.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 51.0 m -85.09 -49.54 8.18 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.601 0.715 . . . . 0.0 110.986 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.2 t -135.96 100.23 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.526 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.523 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . 0.426 ' C ' ' H ' ' A' ' 497' ' ' ASP . 6.0 p-10 -95.19 14.91 20.61 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 122.405 1.097 . . . . 0.0 109.171 174.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -84.64 21.76 1.45 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 127.073 2.149 . . . . 0.0 109.42 178.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 495' ' ' ASP . 9.7 t70 -53.16 -1.44 0.02 OUTLIER 'General case' 0 CA--C 1.563 1.46 0 C-N-CA 128.991 2.916 . . . . 0.0 114.709 -176.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -73.88 -0.99 17.69 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 120.686 -1.259 . . . . 0.0 112.033 -175.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -83.46 -18.84 37.2 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.897 177.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . 0.459 ' HB ' ' HB3' ' A' ' 504' ' ' PHE . 23.4 p -60.87 158.23 13.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -172.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -91.8 167.31 12.25 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.533 175.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -59.84 -24.32 64.11 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 118.453 0.57 . . . . 0.0 110.054 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -54.79 -53.65 52.41 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 175.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . 0.566 ' CD2' ' HB3' ' A' ' 473' ' ' GLU . 10.6 t80 -64.4 -40.02 94.98 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.415 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -57.67 -47.2 82.97 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 123.943 0.777 . . . . 0.0 109.25 -176.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.616 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -60.77 -45.53 93.99 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.135 -179.176 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 45.9 t -62.8 -48.55 87.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 120.385 -0.526 . . . . 0.0 110.221 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -49.54 -49.78 44.68 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.951 0.782 . . . . 0.0 110.654 174.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -58.22 -55.84 29.74 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.946 -177.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 506' ' ' TYR . 12.1 t -57.69 -52.03 62.64 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.512 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 88.9 mt -56.31 -53.05 61.88 Favored 'General case' 0 C--O 1.213 -0.859 0 O-C-N 123.819 0.699 . . . . 0.0 111.421 -176.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -61.64 -38.49 87.87 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.519 0.728 . . . . 0.0 110.588 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -67.49 -52.27 41.22 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.451 -176.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . 0.264 5.0 p90 -73.71 -31.11 63.24 Favored 'General case' 0 C--O 1.192 -1.936 0 C-N-CA 119.008 -1.077 . . . . 0.0 111.985 -178.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . 0.512 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 0.4 OUTLIER -55.67 -41.54 73.8 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.811 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -67.18 -18.69 65.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.151 -0.932 . . . . 0.0 112.497 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -115.67 -44.8 2.93 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 119.948 -0.701 . . . . 0.0 112.168 -178.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . 0.427 ' HB3' ' H ' ' A' ' 519' ' ' ASP . 15.0 m120 -125.59 -151.79 0.49 Allowed 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 124.852 1.261 . . . . 0.0 111.391 -168.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . 0.427 ' H ' ' HB3' ' A' ' 518' ' ' ASN . 6.1 p-10 -105.51 -157.49 0.62 Allowed 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 127.047 2.139 . . . . 0.0 110.456 -173.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -60.51 177.68 0.27 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 125.834 1.654 . . . . 0.0 113.876 -170.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -90.29 146.92 23.84 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.87 1.668 . . . . 0.0 109.085 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -118.58 155.33 31.12 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 50.1 pt -64.0 -21.87 29.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 O-C-N 122.249 -0.282 . . . . 0.0 111.567 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 22.7 t -57.66 -34.87 69.82 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -63.71 -50.32 69.65 Favored 'General case' 0 C--N 1.349 0.549 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -59.0 -44.37 91.66 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.594 0.712 . . . . 0.0 110.857 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.502 ' O ' HG22 ' A' ' 530' ' ' VAL . 55.8 t -65.1 -37.46 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.531 0 C-N-CA 124.052 0.941 . . . . 0.0 111.912 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -70.21 -16.85 63.11 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 117.95 -1.5 . . . . 0.0 110.213 175.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -80.59 6.42 12.65 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 172.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.502 HG22 ' O ' ' A' ' 527' ' ' VAL . 26.9 m -74.34 10.63 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.514 173.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -99.12 -15.02 19.13 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.943 177.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . 0.478 ' HB2' ' HB2' ' A' ' 535' ' ' LEU . 27.1 m -88.69 156.2 19.14 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -63.18 -75.01 0.08 Allowed 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -86.4 -28.55 23.51 Favored 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 121.399 0.619 . . . . 0.0 110.257 -173.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.478 ' HB2' ' HB2' ' A' ' 532' ' ' SER . 58.3 mt -62.08 -32.95 73.55 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.942 -174.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -53.84 -63.43 1.15 Allowed 'General case' 0 C--O 1.255 1.37 0 O-C-N 124.293 0.996 . . . . 0.0 109.675 176.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -63.26 -55.72 22.52 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.359 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.421 ' O ' HD13 ' A' ' 542' ' ' LEU . 23.4 m -58.83 -53.81 54.21 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -174.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . 0.422 HD13 ' HA ' ' A' ' 539' ' ' LEU 0.299 4.0 mm? -63.88 -40.4 96.45 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -176.493 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 58.6 mt -68.85 -34.91 66.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 118.637 -1.225 . . . . 0.0 109.774 176.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 34.6 t -56.76 -48.91 76.76 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.5 ' HA ' ' CE2' ' A' ' 545' ' ' TYR . 6.6 mp -64.7 -32.22 73.8 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 124.671 1.188 . . . . 0.0 112.454 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.59 -54.83 7.26 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . 0.551 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 46.9 tt0 -74.64 35.08 0.1 Allowed 'General case' 0 CA--C 1.564 1.489 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -173.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . 0.5 ' CE2' ' HA ' ' A' ' 542' ' ' LEU . 16.6 m-85 -77.28 166.35 23.29 Favored 'General case' 0 C--N 1.265 -3.105 0 O-C-N 120.491 -1.38 . . . . 0.0 110.882 170.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -93.5 117.85 30.59 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 92.8 mt -74.43 -16.27 60.88 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.199 -176.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -70.5 -43.07 70.44 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.838 177.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . 0.467 ' C ' ' HD3' ' A' ' 551' ' ' PRO . 40.6 m-20 -74.81 1.21 13.1 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.424 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.406 ' N ' ' HD3' ' A' ' 551' ' ' PRO . 35.6 tt0 -119.59 67.99 10.83 Favored Pre-proline 0 CA--C 1.567 1.623 0 C-N-CA 119.262 -0.975 . . . . 0.0 113.039 -175.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . 0.524 ' HD2' ' H ' ' A' ' 552' ' ' TYR . 72.1 Cg_endo -119.25 -14.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.579 2.747 0 C-N-CA 122.24 1.96 . . . . 0.0 114.658 168.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . 0.524 ' H ' ' HD2' ' A' ' 551' ' ' PRO . 48.7 m-85 -114.15 52.8 0.81 Allowed 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 124.773 1.229 . . . . 0.0 108.287 -171.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . 0.277 7.5 mm-40 -58.84 67.84 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 118.622 2.823 . . . . 0.0 118.622 -170.049 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . 0.4 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 9.6 m120 -65.94 -20.95 66.38 Favored 'General case' 0 C--O 1.194 -1.816 0 CA-C-N 113.649 -1.614 . . . . 0.0 108.992 169.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -43.91 -41.01 4.95 Favored 'General case' 0 C--O 1.204 -1.294 0 C-N-CA 124.611 1.164 . . . . 0.0 111.519 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 62.1 mt -64.17 -45.32 96.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . 0.4 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 13.7 t70 -60.03 -45.49 92.62 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.256 175.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . 0.504 ' O ' HG23 ' A' ' 562' ' ' VAL . 18.4 t70 -58.16 -56.34 23.34 Favored 'General case' 0 CA--C 1.503 -0.828 0 C-N-CA 124.404 1.082 . . . . 0.0 109.407 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -48.03 -53.16 17.21 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 125.28 1.432 . . . . 0.0 110.138 176.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 37.2 t -57.69 -50.94 75.84 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.949 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.772 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.04 -31.41 71.82 Favored 'General case' 0 C--O 1.209 -1.034 0 C-N-CA 123.3 0.64 . . . . 0.0 111.677 -179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 558' ' ' ASP . 78.0 t -69.0 -34.71 65.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 CA-C-O 121.329 0.585 . . . . 0.0 111.776 178.088 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . . . . . . . . . 57.3 mt -87.41 -35.67 8.72 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.248 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -77.62 2.57 16.22 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 113.694 -1.594 . . . . 0.0 109.83 176.52 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.32 -31.09 67.01 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 174.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp . . . . . 0 C--N 1.313 -0.991 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -174.442 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 96.5 mt . . . . . 0 N--CA 1.431 -1.388 0 CA-C-O 121.37 0.605 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 15.0 m -95.16 150.34 20.31 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.891 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' A' ' 471' ' ' LYS . 19.9 tpp180 -60.98 -20.38 62.32 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.621 1.169 . . . . 0.0 110.712 -178.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.714 HE21 ' N ' ' A' ' 469' ' ' GLN . 0.0 OUTLIER -58.99 -40.57 85.25 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.642 177.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 34.2 tt0 -67.03 -30.81 71.0 Favored 'General case' 0 C--O 1.203 -1.345 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 468' ' ' ARG . 27.1 tptp -62.48 -37.93 87.88 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.904 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -64.44 -45.43 87.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.559 0.695 . . . . 0.0 109.239 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.94 -33.46 74.31 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.745 177.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.582 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 98.9 mtt180 -65.92 -36.8 84.37 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 122.459 0.304 . . . . 0.0 110.524 175.118 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -65.9 -45.5 81.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.307 0.575 . . . . 0.0 109.954 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.28 -27.78 68.71 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 122.031 0.919 . . . . 0.0 111.173 175.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.48 ' HB3' ' O ' ' A' ' 474' ' ' ARG . 61.8 tp -77.22 -14.83 59.7 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 126.004 1.722 . . . . 0.0 113.557 -175.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -41.12 -50.26 3.46 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.312 1.045 . . . . 0.0 110.833 -173.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -168.2 128.23 1.28 Allowed 'General case' 0 CA--C 1.48 -1.73 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 166.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.515 ' HG ' ' OD2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -58.48 119.49 7.09 Favored 'General case' 0 C--O 1.251 1.145 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 -179.599 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 72.8 mtm -93.21 -53.57 4.05 Favored 'General case' 0 N--CA 1.424 -1.759 0 N-CA-C 115.343 1.608 . . . . 0.0 115.343 -172.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . 0.641 ' HB2' ' OG1' ' A' ' 486' ' ' THR 0.255 36.4 mmt180 -76.33 -99.05 0.02 OUTLIER 'General case' 0 C--O 1.212 -0.875 0 C-N-CA 116.379 -2.129 . . . . 0.0 114.409 -174.263 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . 0.644 ' OD2' ' HG3' ' A' ' 484' ' ' LYS . 25.4 t70 -145.72 -86.89 0.11 Allowed 'General case' 0 C--O 1.196 -1.726 0 C-N-CA 115.639 -2.424 . . . . 0.0 116.819 170.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . 0.644 ' HG3' ' OD2' ' A' ' 483' ' ' ASP . 61.8 mttp -97.54 -52.33 3.82 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.669 -1.15 . . . . 0.0 113.464 -178.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -56.45 -42.75 78.69 Favored 'General case' 0 CA--C 1.497 -1.085 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.88 -178.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.641 ' OG1' ' HB2' ' A' ' 482' ' ' ARG . 42.2 m -61.51 -37.57 84.2 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.975 -177.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -62.62 -54.12 44.32 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.658 177.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 77.5 mt -66.8 -28.46 68.4 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -61.49 -40.97 96.5 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 123.765 0.826 . . . . 0.0 110.659 -179.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -92.51 -37.15 12.67 Favored 'General case' 0 N--CA 1.399 -3.02 0 C-N-CA 120.486 -0.485 . . . . 0.0 110.732 178.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -79.95 -59.65 2.64 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -175.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -78.82 -7.4 57.83 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.839 0.828 . . . . 0.0 111.751 -166.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 18.2 m -75.51 -6.8 52.04 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.469 177.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 46.0 t -100.27 99.22 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -97.45 -82.84 0.41 Allowed 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -83.17 -26.88 30.49 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.575 0.702 . . . . 0.0 110.876 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . 0.408 ' C ' ' H ' ' A' ' 499' ' ' PHE . 38.0 t70 -77.56 31.09 0.15 Allowed 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 125.574 1.55 . . . . 0.0 110.914 -178.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -72.93 33.53 0.07 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.688 1.195 . . . . 0.0 111.78 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . 0.408 ' H ' ' C ' ' A' ' 497' ' ' ASP . 15.1 p90 -73.52 -13.81 61.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.055 -179.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.84 150.78 31.78 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -74.72 163.81 27.28 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 114.801 -1.091 . . . . 0.0 112.052 -172.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . 0.47 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 8.7 tt0 -56.18 -5.22 0.17 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.438 1.895 . . . . 0.0 111.839 177.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -52.6 -45.17 66.43 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 172.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.84 -30.31 70.03 Favored 'General case' 0 C--O 1.204 -1.301 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.646 175.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 22.1 tptm -70.35 -47.75 59.54 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.241 0.617 . . . . 0.0 110.332 -175.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.517 ' O ' HG23 ' A' ' 510' ' ' VAL . 96.9 m-85 -59.63 -46.8 87.92 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . 0.413 ' CG2' HD11 ' A' ' 477' ' ' LEU . 71.1 t -58.25 -57.49 10.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 114.227 -1.351 . . . . 0.0 111.263 178.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -48.41 -45.59 36.32 Favored 'General case' 0 C--O 1.212 -0.885 0 O-C-N 124.047 0.842 . . . . 0.0 112.349 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.3 -53.77 52.46 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.048 0.452 . . . . 0.0 110.491 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 506' ' ' TYR . 24.5 t -60.85 -51.35 74.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 CA-C-O 121.368 0.604 . . . . 0.0 111.097 -178.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 10.4 mp -66.91 -34.05 76.92 Favored 'General case' 0 C--O 1.2 -1.546 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.482 -175.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -65.85 -29.53 70.0 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 120.99 0.424 . . . . 0.0 110.548 176.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.12 -37.05 80.7 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . 0.405 ' HB3' ' HA ' ' A' ' 519' ' ' ASP . 28.9 m-85 -76.46 -46.16 28.1 Favored 'General case' 0 C--O 1.2 -1.551 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.324 178.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -46.21 -32.83 3.24 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.901 1.68 . . . . 0.0 111.129 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -57.55 -29.8 64.69 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.783 178.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.508 ' HG3' HD22 ' A' ' 518' ' ' ASN . 11.5 tp10 -119.77 -59.73 1.78 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.016 175.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . 0.508 HD22 ' HG3' ' A' ' 517' ' ' GLU . 6.5 p30 -158.31 124.32 4.61 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 176.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . 0.515 ' OD2' ' HG ' ' A' ' 480' ' ' LEU . 24.3 t0 -95.4 96.75 9.32 Favored 'General case' 0 CA--C 1.484 -1.572 0 C-N-CA 117.274 -1.77 . . . . 0.0 110.468 179.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 482' ' ' ARG . 88.5 mt-30 -137.86 77.1 1.61 Allowed 'General case' 0 C--N 1.274 -2.7 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 178.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -46.53 121.05 3.21 Favored 'General case' 0 N--CA 1.427 -1.588 0 C-N-CA 126.093 1.757 . . . . 0.0 113.039 -174.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -91.02 167.13 12.61 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.602 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 44.7 pt -87.07 -17.37 8.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 C-N-CA 120.166 -0.614 . . . . 0.0 112.132 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 23.0 t -60.16 -46.17 90.6 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.19 -38.04 87.6 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.676 176.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -60.37 -48.03 83.53 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 120.998 0.428 . . . . 0.0 110.409 176.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.518 ' O ' HG22 ' A' ' 530' ' ' VAL . 97.5 t -64.98 -30.71 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 C-N-CA 123.719 0.807 . . . . 0.0 111.018 177.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -65.1 -32.55 74.31 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.416 -0.802 . . . . 0.0 109.159 172.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -77.71 10.78 2.47 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 176.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.518 HG22 ' O ' ' A' ' 527' ' ' VAL . 22.1 m -75.26 6.79 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 118.313 -1.355 . . . . 0.0 111.264 171.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -93.59 -8.06 42.28 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.079 175.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 20.1 m -85.66 154.76 21.45 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 176.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -71.71 -73.11 0.19 Allowed 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 178.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -81.22 -36.8 29.58 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.837 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 43.9 tp -65.16 -34.6 78.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.865 -177.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 38.2 ttp180 -57.89 -54.53 45.88 Favored 'General case' 0 C--O 1.254 1.315 0 CA-C-O 121.718 0.77 . . . . 0.0 109.344 176.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -53.42 -70.34 0.09 Allowed 'General case' 0 N--CA 1.425 -1.696 0 CA-C-N 113.369 -1.741 . . . . 0.0 110.669 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.441 ' O ' HD13 ' A' ' 542' ' ' LEU 0.291 6.4 p -64.4 -52.69 56.91 Favored 'General case' 0 N--CA 1.425 -1.688 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -173.18 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 51.8 tp -59.03 -44.43 91.74 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -174.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 1.8 mp -75.04 -38.87 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 119.551 -0.86 . . . . 0.0 109.43 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 30.1 t -55.41 -45.6 76.71 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.484 175.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 545' ' ' TYR . 5.2 mp -64.95 -37.53 87.96 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.063 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . 0.478 ' C ' ' H ' ' A' ' 545' ' ' TYR . 13.1 tp10 -64.99 -33.62 76.49 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.884 0.373 . . . . 0.0 110.886 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -76.43 40.9 0.23 Allowed 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 123.048 1.404 . . . . 0.0 110.67 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . 0.499 ' HB2' ' O ' ' A' ' 542' ' ' LEU . 2.8 t80 -72.09 -172.69 0.92 Allowed 'General case' 0 C--N 1.283 -2.294 0 C-N-CA 128.658 2.783 . . . . 0.0 110.658 -176.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . 0.474 ' HB2' ' OD1' ' A' ' 548' ' ' ASN . 1.6 m-80 -85.98 172.08 10.94 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -80.02 14.19 1.94 Allowed 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.158 0.504 . . . . 0.0 111.689 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . 0.474 ' OD1' ' HB2' ' A' ' 546' ' ' ASN . 3.6 p-10 -75.94 -2.03 28.39 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 123.901 0.88 . . . . 0.0 112.472 -176.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -69.75 33.34 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.416 ' HB3' ' CD ' ' A' ' 551' ' ' PRO . 46.2 mt-10 -103.15 -176.99 0.48 Allowed Pre-proline 0 C--N 1.305 -1.336 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 172.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . 0.416 ' CD ' ' HB3' ' A' ' 550' ' ' GLU . 33.7 Cg_exo -62.97 61.95 0.16 Allowed 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.433 2.089 . . . . 0.0 113.807 176.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -135.22 37.73 2.97 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 105.839 -1.911 . . . . 0.0 105.839 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -67.9 67.12 0.1 Allowed 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -171.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -71.3 -21.45 62.07 Favored 'General case' 0 CA--C 1.491 -1.31 0 C-N-CA 125.279 1.432 . . . . 0.0 108.573 172.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -45.17 -45.31 11.46 Favored 'General case' 0 C--O 1.207 -1.174 0 C-N-CA 124.63 1.172 . . . . 0.0 109.222 171.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 53.9 mt -67.4 -44.21 87.13 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.447 0 O-C-N 123.649 0.593 . . . . 0.0 109.483 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -59.14 -47.34 85.64 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 120.97 0.415 . . . . 0.0 111.152 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.83 -42.47 81.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.073 0.549 . . . . 0.0 110.286 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . 0.579 ' O ' HG12 ' A' ' 563' ' ' ILE . 93.4 t80 -53.6 -51.57 62.6 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.809 1.244 . . . . 0.0 108.763 173.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 9.6 t -55.07 -52.19 46.75 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.751 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.483 175.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -55.57 -38.01 68.78 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.34 0.656 . . . . 0.0 111.441 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 62.9 t -73.6 -32.93 37.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 177.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.579 HG12 ' O ' ' A' ' 559' ' ' TYR . 42.0 mm -90.59 -33.87 6.15 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.956 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -174.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -86.61 14.64 6.6 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 113.783 -1.553 . . . . 0.0 108.14 176.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -70.85 -19.76 62.61 Favored 'General case' 0 C--N 1.347 0.459 0 N-CA-C 105.494 -2.039 . . . . 0.0 105.494 169.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . 0.422 ' HE2' ' OE1' ' A' ' 469' ' ' GLN . 74.3 mmtt . . . . . 0 CA--C 1.548 0.878 0 CA-C-N 113.783 -1.553 . . . . 0.0 109.571 173.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 75.7 mt . . . . . 0 C--O 1.252 1.196 0 CA-C-O 120.92 0.39 . . . . 0.0 111.077 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 20.0 m -99.5 133.66 43.5 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 36.5 ttm105 -60.01 -23.61 63.81 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.489 1.138 . . . . 0.0 109.255 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.583 ' O ' ' HG2' ' A' ' 473' ' ' GLU . 82.4 mt-30 -54.45 -38.14 66.01 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 126.4 1.88 . . . . 0.0 113.308 -177.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.498 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 1.8 tm-20 -68.45 -39.16 81.58 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.337 0.589 . . . . 0.0 109.629 -175.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -67.73 -33.5 74.99 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.992 175.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -70.19 -39.98 74.91 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.703 178.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 469' ' ' GLN . 6.6 mm-40 -60.88 -39.75 90.39 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.498 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 95.4 mtt180 -59.49 -47.2 86.43 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.898 176.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -65.36 -35.42 80.91 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.054 -178.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.63 -57.63 12.15 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.906 0.754 . . . . 0.0 109.42 179.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 27.3 mt -67.74 -31.61 71.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.553 -175.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.422 ' HG3' ' HB3' ' A' ' 542' ' ' LEU 0.281 23.3 mmmt -102.54 -5.86 23.49 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 116.917 2.191 . . . . 0.0 116.917 -175.603 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 24.7 m170 -99.4 -22.32 15.59 Favored 'General case' 0 CA--C 1.488 -1.437 0 C-N-CA 119.21 -0.996 . . . . 0.0 110.848 173.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 48.6 tp -115.98 102.26 9.5 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 24.0 mmt -67.49 -26.36 66.32 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 122.394 1.093 . . . . 0.0 108.253 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . 0.634 ' HA ' ' NE2' ' A' ' 520' ' ' GLN . 3.4 mpt_? -69.14 -7.1 33.04 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 113.707 -1.588 . . . . 0.0 113.858 176.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . 0.472 ' CG ' ' HB ' ' A' ' 486' ' ' THR . 3.4 t70 -71.4 56.8 0.25 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 122.517 1.151 . . . . 0.0 111.889 -176.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . 0.513 ' O ' ' HB3' ' A' ' 487' ' ' PHE . 82.3 tttt -93.77 -63.87 1.15 Allowed 'General case' 0 C--O 1.268 2.066 0 CA-C-O 123.066 1.412 . . . . 0.0 107.84 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -60.92 -46.18 91.68 Favored 'General case' 0 CA--C 1.491 -1.307 0 CA-C-N 113.546 -1.661 . . . . 0.0 108.059 175.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.472 ' HB ' ' CG ' ' A' ' 483' ' ' ASP . 1.3 m -62.16 -35.7 79.6 Favored 'General case' 0 C--O 1.189 -2.127 0 CA-C-N 114.251 -1.34 . . . . 0.0 110.957 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . 0.513 ' HB3' ' O ' ' A' ' 484' ' ' LYS . 7.4 t80 -51.35 -56.37 13.47 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.132 0.492 . . . . 0.0 110.708 174.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.58 -27.47 62.21 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 118.541 -1.264 . . . . 0.0 110.667 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -75.18 -32.22 61.19 Favored 'General case' 0 C--O 1.211 -0.964 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . 0.425 ' HD1' ' O ' ' A' ' 487' ' ' PHE . 0.0 OUTLIER -73.53 -37.68 65.53 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 -178.502 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . 0.507 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 4.0 t80 -65.42 -42.26 92.69 Favored 'General case' 0 N--CA 1.411 -2.424 0 CA-C-N 112.467 -2.151 . . . . 0.0 109.706 -177.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -81.6 -32.21 32.16 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.181 -176.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 35.1 m -83.45 -51.29 7.49 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.9 t -128.93 99.06 4.53 Favored 'Isoleucine or valine' 0 C--O 1.244 0.777 0 C-N-CA 118.067 -1.453 . . . . 0.0 113.363 -170.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 35.8 t70 34.26 87.04 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 127.701 2.4 . . . . 0.0 116.929 172.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 5.9 ptmt -90.14 -43.49 10.42 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 177.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.82 -61.53 2.55 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 -161.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -78.94 -10.99 59.98 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 118.769 -1.172 . . . . 0.0 110.723 -174.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -86.04 -17.02 36.33 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.778 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 30.3 m -63.02 113.73 3.27 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -174.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -94.49 150.06 20.63 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 171.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -57.88 -34.15 69.46 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.276 0.489 . . . . 0.0 111.025 -177.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 506' ' ' TYR . 82.8 t60 -64.99 -50.37 66.6 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 124.138 0.975 . . . . 0.0 109.726 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -64.65 -31.09 72.16 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.747 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -65.38 -35.61 81.48 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.473 ' CG ' HD11 ' A' ' 535' ' ' LEU . 12.0 m-85 -59.21 -43.47 92.26 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.686 173.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 9.7 t -61.73 -46.22 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 120.368 -0.533 . . . . 0.0 109.724 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -49.05 -44.44 41.72 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 123.406 0.441 . . . . 0.0 110.625 175.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -60.3 -48.28 82.43 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.035 -179.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.469 HG22 ' CE2' ' A' ' 529' ' ' TYR . 2.9 t -57.19 -43.49 81.82 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.847 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.739 ' HA ' ' HB3' ' A' ' 514' ' ' PHE . 94.7 mt -73.27 -34.27 65.71 Favored 'General case' 0 CA--C 1.565 1.544 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -176.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 30.3 t60 -67.43 -42.92 82.39 Favored 'General case' 0 C--O 1.259 1.566 0 CA-C-O 122.257 1.027 . . . . 0.0 108.541 174.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.65 -25.42 65.71 Favored 'General case' 0 C--O 1.172 -3.019 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.52 174.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . 0.882 ' O ' ' HA ' ' A' ' 518' ' ' ASN . 34.0 t80 -71.19 -16.39 62.52 Favored 'General case' 0 C--O 1.18 -2.58 0 C-N-CA 127.096 2.159 . . . . 0.0 111.459 174.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -79.85 -44.5 20.39 Favored 'General case' 0 C--N 1.28 -2.429 0 O-C-N 121.406 -0.809 . . . . 0.0 110.747 167.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.84 -53.48 32.09 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 123.119 1.438 . . . . 0.0 108.692 175.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . 0.452 ' O ' ' HA ' ' A' ' 514' ' ' PHE . 45.2 mt-10 -95.33 63.64 2.58 Favored 'General case' 0 C--N 1.281 -2.404 0 C-N-CA 129.003 2.921 . . . . 0.0 104.842 173.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . 0.882 ' HA ' ' O ' ' A' ' 514' ' ' PHE . 12.0 t-20 -59.32 -148.18 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.352 0 C-N-CA 129.886 3.275 . . . . 0.0 114.673 -164.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . 0.651 ' OD2' ' HG3' ' A' ' 520' ' ' GLN . 0.8 OUTLIER -34.07 -167.96 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.579 0 N-CA-C 120.079 3.363 . . . . 0.0 120.079 -136.817 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . 0.651 ' HG3' ' OD2' ' A' ' 519' ' ' ASP 0.313 59.0 mt-30 -59.44 135.68 57.74 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 120.941 3.682 . . . . 0.0 120.941 -146.456 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . 0.471 ' N ' ' HE1' ' A' ' 514' ' ' PHE . 5.2 t80 -41.61 133.37 2.67 Favored 'General case' 0 N--CA 1.416 -2.131 0 C-N-CA 131.09 3.756 . . . . 0.0 114.989 -177.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -119.25 163.91 16.42 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.336 172.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 5.7 tt -54.17 -32.83 23.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 C-N-CA 124.225 1.01 . . . . 0.0 111.002 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.56 ' HA ' HG12 ' A' ' 527' ' ' VAL . 34.8 p -59.48 -32.79 70.57 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.212 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -69.89 -44.07 70.49 Favored 'General case' 0 C--O 1.254 1.314 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -61.03 -51.4 69.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.869 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.56 HG12 ' HA ' ' A' ' 524' ' ' SER . 9.9 p -69.21 -13.62 17.47 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.0 0 C-N-CA 123.14 0.576 . . . . 0.0 110.747 177.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -69.71 -33.85 73.09 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.469 ' CE2' HG22 ' A' ' 510' ' ' VAL 0.256 1.0 OUTLIER -80.63 15.85 1.57 Allowed 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 172.392 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.459 HG23 ' HG3' ' A' ' 536' ' ' ARG . 3.7 p -73.36 5.17 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.042 0 CA-C-O 121.699 0.761 . . . . 0.0 109.83 177.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -95.55 -14.76 23.34 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.702 0.801 . . . . 0.0 110.745 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 8.7 t -106.36 124.49 49.67 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 175.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -58.4 -44.04 88.84 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -170.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.25 -39.7 39.43 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -178.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.473 HD11 ' CG ' ' A' ' 506' ' ' TYR . 96.7 mt -67.36 -36.4 81.31 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-O 119.429 -0.32 . . . . 0.0 111.649 177.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.459 ' HG3' HG23 ' A' ' 530' ' ' VAL . 67.5 ttt180 -49.26 -67.53 0.26 Allowed 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 124.388 1.055 . . . . 0.0 110.522 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -62.13 -43.82 98.0 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.439 -176.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.46 ' O ' HD13 ' A' ' 542' ' ' LEU . 12.0 m -63.08 -54.62 35.16 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 120.217 -0.593 . . . . 0.0 112.542 -178.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.23 -37.01 85.55 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 38.5 mm -68.14 -38.87 80.38 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 70.1 m -57.03 -41.05 77.89 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.192 0.52 . . . . 0.0 110.741 171.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.484 HD21 ' HB3' ' A' ' 474' ' ' ARG . 7.8 mp -70.65 -24.77 62.77 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 123.198 0.599 . . . . 0.0 112.129 176.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -84.86 -35.87 21.93 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.658 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -71.33 29.51 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -176.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -61.93 148.67 42.9 Favored 'General case' 0 C--O 1.257 1.481 0 CA-C-O 121.707 0.765 . . . . 0.0 111.894 -175.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -84.04 -176.37 6.24 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.351 -171.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.428 ' C ' ' H ' ' A' ' 549' ' ' ASP . 7.4 mp -72.27 17.97 0.1 Allowed 'General case' 0 C--O 1.205 -1.253 0 C-N-CA 124.461 1.105 . . . . 0.0 112.458 -179.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . 0.406 ' C ' ' H ' ' A' ' 550' ' ' GLU . 17.0 m120 -75.04 20.83 0.13 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.149 0.98 . . . . 0.0 111.774 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . 0.428 ' H ' ' C ' ' A' ' 547' ' ' LEU . 25.1 t70 -72.69 33.06 0.07 Allowed 'General case' 0 CA--C 1.569 1.689 0 C-N-CA 125.972 1.709 . . . . 0.0 111.911 -176.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.406 ' H ' ' C ' ' A' ' 548' ' ' ASN . 17.0 mm-40 -73.94 170.54 14.09 Favored Pre-proline 0 C--N 1.304 -1.387 0 C-N-CA 124.852 1.261 . . . . 0.0 108.649 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -69.27 73.97 1.1 Allowed 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 121.862 1.708 . . . . 0.0 110.21 171.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -96.24 42.33 1.09 Allowed 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 126.495 1.918 . . . . 0.0 108.356 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . 0.585 ' O ' HG12 ' A' ' 556' ' ' ILE . 50.3 mt-10 -71.44 1.02 6.97 Favored 'General case' 0 C--N 1.281 -2.41 0 CA-C-N 114.633 -1.167 . . . . 0.0 112.464 -178.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -68.36 -21.47 64.72 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.956 1.702 . . . . 0.0 108.909 171.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -46.01 -49.18 16.39 Favored 'General case' 0 C--N 1.347 0.498 0 C-N-CA 124.065 0.946 . . . . 0.0 110.476 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . 0.585 HG12 ' O ' ' A' ' 553' ' ' GLU . 45.4 pt -64.67 -36.46 77.55 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 C-N-CA 123.342 0.657 . . . . 0.0 110.852 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -61.31 -50.9 71.09 Favored 'General case' 0 C--O 1.251 1.167 0 C-N-CA 123.533 0.733 . . . . 0.0 110.693 178.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . 0.441 ' O ' HG23 ' A' ' 562' ' ' VAL . 13.1 t70 -66.99 -42.89 84.3 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.733 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . 0.633 ' CZ ' HG13 ' A' ' 563' ' ' ILE . 52.9 t80 -54.19 -53.85 47.88 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.936 178.009 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 32.0 t -55.12 -47.46 77.22 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.383 0 C-N-CA 122.796 0.438 . . . . 0.0 111.537 -177.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.555 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 47.9 t30 -59.02 -47.24 85.94 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 122.342 0.257 . . . . 0.0 110.523 176.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 558' ' ' ASP . 83.1 t -63.8 -41.76 93.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 121.436 0.636 . . . . 0.0 111.877 -178.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.633 HG13 ' CZ ' ' A' ' 559' ' ' TYR . 50.4 mm -83.25 -33.9 10.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.016 0 CA-C-O 121.489 0.662 . . . . 0.0 109.866 -172.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -73.95 -12.15 60.56 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.555 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 34.3 mt-10 -63.43 -15.75 58.57 Favored 'General case' 0 C--N 1.362 1.151 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.737 174.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 95.9 mttt . . . . . 0 N--CA 1.489 1.501 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.339 175.161 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 6.7 mp . . . . . 0 N--CA 1.429 -1.494 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 48.4 m -75.32 106.0 6.63 Favored 'General case' 0 N--CA 1.42 -1.938 0 CA-C-O 121.554 0.692 . . . . 0.0 111.087 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -69.82 -16.16 63.23 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.404 175.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.454 HE21 HG23 ' A' ' 563' ' ' ILE . 52.6 mt-30 -59.66 -48.31 82.19 Favored 'General case' 0 C--O 1.189 -2.087 0 O-C-N 123.415 0.447 . . . . 0.0 110.075 173.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -60.0 -30.66 69.29 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-O 122.181 0.991 . . . . 0.0 109.887 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 28.3 mmtm -72.85 -32.13 65.24 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.374 174.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.49 -44.51 64.57 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.963 -178.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 477' ' ' LEU . 3.0 mp0 -55.6 -44.97 77.5 Favored 'General case' 0 C--N 1.349 0.581 0 O-C-N 123.349 0.406 . . . . 0.0 110.026 173.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -44.83 95.48 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -64.01 -51.19 65.38 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.752 0.31 . . . . 0.0 111.053 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -18.97 64.58 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-O 121.337 0.589 . . . . 0.0 111.758 -179.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.481 ' O ' HD13 ' A' ' 477' ' ' LEU . 3.0 tm? -77.25 -26.91 53.02 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 123.868 0.867 . . . . 0.0 110.423 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 33.8 tttm -53.65 -70.67 0.09 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.234 0.614 . . . . 0.0 111.012 -172.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.552 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 32.5 m80 61.54 -170.53 0.16 Allowed 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.962 0.905 . . . . 0.0 112.347 176.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 91.5 mt -115.11 175.54 5.46 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 167.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . 0.42 ' HG3' ' O ' ' A' ' 521' ' ' TYR . 1.6 mpt? -73.6 -17.81 61.13 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 121.472 0.653 . . . . 0.0 110.282 -178.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -65.12 -35.03 79.84 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.802 175.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . 0.552 ' HB2' ' HB3' ' A' ' 479' ' ' HIS . 26.9 m-20 -70.85 52.79 0.15 Allowed 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 116.371 1.989 . . . . 0.0 116.371 -169.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -70.7 -42.45 70.63 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.83 -51.78 66.84 Favored 'General case' 0 CA--C 1.501 -0.938 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.797 177.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.514 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 6.0 m -59.73 -32.93 71.01 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.245 -177.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -59.94 -54.82 41.61 Favored 'General case' 0 C--N 1.347 0.464 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 173.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.98 -29.85 67.05 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.872 -178.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -65.02 -41.72 95.03 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 121.259 0.552 . . . . 0.0 109.794 -178.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -83.97 -37.91 21.66 Favored 'General case' 0 N--CA 1.411 -2.421 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.123 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -63.36 -40.08 96.29 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -73.63 -20.3 60.62 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.516 0.674 . . . . 0.0 110.305 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 39.4 m -79.02 -11.65 60.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.109 177.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . 0.503 HG13 ' HB2' ' A' ' 497' ' ' ASP . 55.1 t -94.97 129.85 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.234 0 CA-C-N 115.309 -0.859 . . . . 0.0 108.842 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -156.09 -60.37 0.1 Allowed 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.703 175.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -82.06 -19.68 39.79 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 122.103 0.954 . . . . 0.0 109.561 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . 0.503 ' HB2' HG13 ' A' ' 494' ' ' VAL . 0.6 OUTLIER -69.31 -0.9 6.89 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 126.203 1.801 . . . . 0.0 111.172 -177.523 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -75.59 19.6 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.295 0.638 . . . . 0.0 111.822 -179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.1 p90 -79.02 -16.99 56.11 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 173.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.6 t -58.96 168.41 1.3 Allowed 'General case' 0 CA--C 1.559 1.29 0 C-N-CA 124.843 1.257 . . . . 0.0 111.997 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.24 167.31 10.47 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -175.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -63.59 -12.84 36.31 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.572 1.549 . . . . 0.0 109.55 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -56.23 -44.34 79.51 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 124.721 1.208 . . . . 0.0 109.243 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -60.49 -34.87 74.69 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.954 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -70.12 -43.88 70.06 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -176.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.5 ' O ' HG23 ' A' ' 510' ' ' VAL . 73.9 m-85 -59.89 -46.16 90.21 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.448 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . 0.462 HG21 ' HG ' ' A' ' 477' ' ' LEU . 27.1 m -71.07 -47.17 63.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-O 118.916 -0.564 . . . . 0.0 112.282 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -51.53 -48.87 62.86 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 123.585 0.553 . . . . 0.0 111.835 176.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.91 -52.07 65.41 Favored 'General case' 0 C--O 1.242 0.694 0 O-C-N 124.029 0.83 . . . . 0.0 110.346 -178.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 506' ' ' TYR . 79.0 t -60.18 -50.85 78.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.311 178.067 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 92.5 mt -58.53 -55.77 30.78 Favored 'General case' 0 C--O 1.198 -1.625 0 O-C-N 124.078 0.861 . . . . 0.0 111.741 -176.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -59.95 -39.06 84.28 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.57 0.544 . . . . 0.0 111.694 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -66.04 -51.43 58.29 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.645 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -71.3 -39.29 71.55 Favored 'General case' 0 C--O 1.176 -2.804 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.871 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -53.19 -39.39 63.61 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 122.773 0.429 . . . . 0.0 110.419 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.15 -37.54 78.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -123.01 -2.31 8.7 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -171.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -150.2 -151.36 0.39 Allowed 'General case' 0 C--N 1.274 -2.698 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 -172.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.43 -163.71 1.08 Allowed 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 124.708 1.203 . . . . 0.0 111.868 -173.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.64 160.52 14.22 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . 0.42 ' O ' ' HG3' ' A' ' 481' ' ' MET . 4.0 t80 -41.74 132.2 3.01 Favored 'General case' 0 N--CA 1.415 -2.193 0 C-N-CA 126.816 2.046 . . . . 0.0 115.453 -179.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -116.83 159.15 22.79 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 171.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.4 pp -77.17 -18.91 14.37 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 CA-C-O 121.805 0.812 . . . . 0.0 108.819 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.504 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 8.0 m -57.14 -36.63 70.94 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.095 172.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -64.21 -38.34 90.69 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.343 0.592 . . . . 0.0 109.7 -179.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.49 ' O ' HG13 ' A' ' 530' ' ' VAL . . . -60.95 -46.9 88.86 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.814 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 530' ' ' VAL . 82.7 t -61.95 -36.55 74.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 124.715 1.206 . . . . 0.0 111.444 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . 0.504 ' HG3' ' O ' ' A' ' 524' ' ' SER . 77.9 mt-30 -62.86 -36.08 82.08 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.651 0.739 . . . . 0.0 110.067 178.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.541 ' CG ' ' HD3' ' A' ' 536' ' ' ARG . 0.3 OUTLIER -76.15 -15.01 60.15 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.68 -176.755 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 527' ' ' VAL . 17.3 m -86.19 18.29 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 N-CA-C 116.037 1.865 . . . . 0.0 116.037 -170.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -96.99 -27.23 14.71 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 105.588 -2.005 . . . . 0.0 105.588 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . 0.401 ' C ' ' H ' ' A' ' 534' ' ' GLU . 14.9 m -92.8 -142.33 0.21 Allowed 'General case' 0 C--N 1.292 -1.923 0 C-N-CA 128.871 2.868 . . . . 0.0 107.007 174.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . 0.429 ' O ' ' N ' ' A' ' 535' ' ' LEU . 13.4 m120 -29.08 28.08 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.851 1 C-N-CA 136.365 5.866 . . . . 0.0 117.559 173.161 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . 0.712 ' O ' ' HG3' ' A' ' 537' ' ' GLU . 10.4 pt-20 -33.28 2.27 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.633 0 C-N-CA 131.32 3.848 . . . . 0.0 116.348 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.455 ' O ' ' HB ' ' A' ' 538' ' ' THR . 3.1 pp -64.93 -17.19 64.14 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 162.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.541 ' HD3' ' CG ' ' A' ' 529' ' ' TYR . 21.0 ttt180 -80.52 -11.99 59.59 Favored 'General case' 0 N--CA 1.402 -2.855 0 CA-C-N 113.149 -1.841 . . . . 0.0 111.288 174.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . 0.712 ' HG3' ' O ' ' A' ' 534' ' ' GLU . 0.1 OUTLIER -79.15 -32.35 44.3 Favored 'General case' 0 CA--C 1.475 -1.909 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 171.921 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.455 ' HB ' ' O ' ' A' ' 535' ' ' LEU . 62.4 m -59.54 -43.22 93.54 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 114.663 -1.153 . . . . 0.0 109.189 170.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 11.2 tp -56.75 -40.51 75.92 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.136 175.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . 0.479 HD11 ' HA ' ' A' ' 527' ' ' VAL . 80.6 mt -61.17 -49.24 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 C-N-CA 122.81 0.444 . . . . 0.0 110.391 176.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.4 m -54.26 -43.23 70.8 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.854 0.835 . . . . 0.0 110.668 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 34.5 tp -72.75 -25.4 61.18 Favored 'General case' 0 CA--C 1.565 1.556 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.208 177.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -79.73 -28.09 40.54 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.717 1.207 . . . . 0.0 109.656 -178.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -68.45 -27.49 66.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.739 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -65.76 115.01 5.45 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.177 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . 0.438 ' ND2' ' HB2' ' A' ' 549' ' ' ASP . 58.1 t30 -109.06 82.56 1.61 Allowed 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.317 -174.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -84.48 -15.4 46.14 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.735 176.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -78.71 -3.1 42.53 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.443 -178.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . 0.438 ' HB2' ' ND2' ' A' ' 546' ' ' ASN . 19.0 t70 -62.57 -44.06 97.27 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.903 0.859 . . . . 0.0 109.187 176.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -85.34 156.87 59.51 Favored Pre-proline 0 C--N 1.291 -1.956 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -50.89 112.03 0.68 Allowed 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 122.277 1.984 . . . . 0.0 108.816 173.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -118.46 31.81 6.47 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.636 0.731 . . . . 0.0 110.109 -169.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -70.91 -6.09 35.75 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.677 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -66.34 -20.73 66.16 Favored 'General case' 0 C--O 1.214 -0.79 0 C-N-CA 124.984 1.314 . . . . 0.0 109.617 171.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . 0.415 ' HG3' HG13 ' A' ' 556' ' ' ILE . 8.8 pt-20 -37.78 -54.29 1.24 Allowed 'General case' 0 C--O 1.204 -1.306 0 C-N-CA 123.798 0.839 . . . . 0.0 113.026 179.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . 0.415 HG13 ' HG3' ' A' ' 555' ' ' GLU . 20.5 mt -67.61 -42.64 86.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -176.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -56.06 -52.46 64.17 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.898 0.748 . . . . 0.0 110.121 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -65.03 -57.88 7.52 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.745 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -50.99 -54.14 27.08 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 124.932 1.293 . . . . 0.0 112.615 -176.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.1 t -71.52 -40.65 72.0 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.386 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.594 -176.672 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -60.29 -34.82 74.3 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 117.959 0.345 . . . . 0.0 110.686 178.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.26 -36.5 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 121.383 0.611 . . . . 0.0 111.907 177.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.454 HG23 HE21 ' A' ' 469' ' ' GLN . 60.2 mt -84.63 -36.5 11.62 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.01 0 CA-C-O 122.204 1.002 . . . . 0.0 108.328 -176.09 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -81.56 7.21 12.68 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.348 176.34 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -71.66 -20.3 61.97 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 172.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp . . . . . 0 CA--C 1.55 0.98 0 CA-C-N 113.925 -1.489 . . . . 0.0 107.383 172.327 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 7.1 mp . . . . . 0 N--CA 1.444 -0.773 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 18.4 m -71.06 135.58 47.82 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -174.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 19.6 mmt85 -60.12 -38.79 84.09 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 123.138 1.447 . . . . 0.0 107.199 173.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.572 ' HG3' ' HA ' ' A' ' 563' ' ' ILE . 18.3 mp0 -64.14 -21.76 66.67 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 112.768 -2.015 . . . . 0.0 111.555 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.66 ' O ' ' HG2' ' A' ' 474' ' ' ARG . 55.3 tt0 -66.28 -40.79 90.32 Favored 'General case' 0 C--O 1.209 -1.047 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -62.58 -41.53 99.0 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -58.17 -46.26 86.04 Favored 'General case' 0 C--O 1.243 0.738 0 O-C-N 123.675 0.609 . . . . 0.0 109.89 175.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -57.57 -50.29 73.59 Favored 'General case' 0 C--O 1.2 -1.548 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.957 175.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.66 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 18.7 mmm-85 -59.18 -32.0 69.51 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 120.77 0.319 . . . . 0.0 110.327 -178.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -66.02 -57.59 7.41 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . 0.416 ' HB3' ' HB2' ' A' ' 490' ' ' TYR . 1.4 m-85 -62.53 -35.4 79.31 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 178.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 25.8 tp -73.17 -9.0 58.25 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 124.941 1.296 . . . . 0.0 112.352 -176.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -46.51 -40.04 11.85 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.207 1.003 . . . . 0.0 113.577 -179.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.956 ' HA ' HG21 ' A' ' 486' ' ' THR 0.256 0.3 OUTLIER 84.76 130.15 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 126.574 1.949 . . . . 0.0 111.753 -177.153 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -93.42 -96.25 0.15 Allowed 'General case' 0 N--CA 1.427 -1.591 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.406 175.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . . . . . . . . 0.398 0.5 OUTLIER -95.84 -91.37 0.22 Allowed 'General case' 0 CA--C 1.472 -2.04 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 179.905 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . 0.603 ' HB3' ' O ' ' A' ' 519' ' ' ASP . 12.6 mtm180 -79.04 -100.33 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.668 0 C-N-CA 116.689 -2.004 . . . . 0.0 111.202 -174.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . 0.593 ' HB3' ' HB2' ' A' ' 519' ' ' ASP . 10.1 t70 -142.46 -54.72 0.43 Allowed 'General case' 0 C--N 1.296 -1.74 0 C-N-CA 123.453 0.701 . . . . 0.0 109.262 173.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 34.3 tttm -34.53 -66.45 0.17 Allowed 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 113.046 -1.888 . . . . 0.0 113.746 -170.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -58.95 -52.9 63.79 Favored 'General case' 0 C--O 1.202 -1.442 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.546 -173.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.956 HG21 ' HA ' ' A' ' 479' ' ' HIS . 93.8 m -61.03 -48.15 83.09 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.778 -177.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -54.92 -59.09 5.21 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 124.431 1.082 . . . . 0.0 108.959 -177.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 85.0 mt -68.65 -27.64 66.18 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.421 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -64.36 -30.8 71.83 Favored 'General case' 0 CA--C 1.489 -1.375 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . 0.448 ' O ' HG23 ' A' ' 494' ' ' VAL . 2.0 t80 -95.53 -53.43 3.74 Favored 'General case' 1 N--CA 1.367 -4.613 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 176.484 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -63.96 -40.24 95.95 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 124.747 1.219 . . . . 0.0 114.146 -167.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -81.93 -10.68 59.2 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.436 0.636 . . . . 0.0 112.17 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 17.8 m -84.84 -11.76 54.98 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.05 176.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 490' ' ' TYR . 23.9 t -113.72 109.39 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.863 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.256 -176.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -95.23 -17.1 22.0 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -89.56 20.61 3.86 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 113.329 -1.76 . . . . 0.0 111.647 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -58.51 -6.9 0.78 Allowed 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -174.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.57 -9.82 59.69 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 120.898 -1.126 . . . . 0.0 110.58 176.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -82.22 -9.41 59.51 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.783 176.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 20.4 p -56.14 160.91 2.66 Favored 'General case' 0 C--O 1.25 1.103 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -174.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.712 ' OD1' ' HB2' ' A' ' 503' ' ' HIS . 8.0 p30 -91.64 161.73 14.79 Favored 'General case' 0 N--CA 1.416 -2.145 0 CA-C-N 114.03 -1.441 . . . . 0.0 111.03 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -77.42 -23.31 50.62 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.571 0.7 . . . . 0.0 109.623 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . 0.712 ' HB2' ' OD1' ' A' ' 501' ' ' ASN . 32.3 m170 -61.42 -46.24 90.94 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 175.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . 0.429 ' CE1' ' CE1' ' A' ' 490' ' ' TYR . 72.2 t80 -57.65 -35.43 70.53 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.266 -1.334 . . . . 0.0 111.197 173.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -63.93 -48.85 74.94 Favored 'General case' 0 CA--C 1.482 -1.652 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -175.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.495 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.2 OUTLIER -61.32 -37.67 84.09 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 118.283 -1.367 . . . . 0.0 110.17 -179.076 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . 0.462 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 23.3 t -66.85 -54.53 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 120.291 -0.563 . . . . 0.0 110.785 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -48.97 -39.87 28.23 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.849 0.86 . . . . 0.0 110.873 176.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -59.52 -56.34 23.2 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.362 1.065 . . . . 0.0 110.376 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 506' ' ' TYR . 2.5 t -64.44 -41.16 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.445 178.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 83.7 mt -58.75 -53.78 54.49 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.251 0.548 . . . . 0.0 111.488 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -62.82 -32.13 73.27 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.695 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.32 -40.98 98.12 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 120.773 0.321 . . . . 0.0 110.254 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . 0.446 ' CE2' HG12 ' A' ' 510' ' ' VAL . 33.4 m-85 -69.11 -57.09 5.86 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -49.03 -34.53 13.56 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.893 1.277 . . . . 0.0 111.307 -178.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.06 -23.97 66.63 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -112.38 -58.01 2.2 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.45 0.643 . . . . 0.0 110.021 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -158.01 121.54 4.01 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 125.345 1.458 . . . . 0.0 108.352 175.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . 0.603 ' O ' ' HB3' ' A' ' 482' ' ' ARG . 1.9 p30 -77.78 98.72 5.64 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-O 121.064 0.459 . . . . 0.0 111.698 -172.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -143.04 140.97 31.19 Favored 'General case' 0 CA--C 1.491 -1.315 0 O-C-N 121.437 -0.79 . . . . 0.0 110.938 167.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -85.0 105.9 16.1 Favored 'General case' 0 N--CA 1.402 -2.864 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 170.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -85.5 110.41 19.18 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -177.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 5.0 tt -55.85 -33.32 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 C-N-CA 124.58 1.152 . . . . 0.0 110.907 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.581 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 48.1 t -58.34 -38.64 77.56 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.083 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -65.26 -43.57 90.84 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -58.11 -52.47 65.43 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.137 179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.587 ' HA ' HG13 ' A' ' 530' ' ' VAL . 8.9 p -67.77 -24.02 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 CA-C-O 121.063 0.459 . . . . 0.0 111.88 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 524' ' ' SER . 26.2 mt-30 -67.65 -26.62 66.31 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 121.144 -0.972 . . . . 0.0 109.484 172.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 526' ' ' ALA . 47.5 m-85 -75.01 -0.49 19.0 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 118.136 -0.935 . . . . 0.0 112.659 174.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.637 ' HA ' ' NH1' ' A' ' 536' ' ' ARG . 32.3 m -72.37 20.88 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.532 3.666 0 N-CA-C 116.589 2.07 . . . . 0.0 116.589 -173.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -128.99 -40.5 1.5 Allowed 'General case' 0 C--N 1.278 -2.521 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 173.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.58 -144.62 0.03 OUTLIER 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 128.729 2.812 . . . . 0.0 112.062 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . 0.497 ' C ' ' H ' ' A' ' 535' ' ' LEU . 45.3 t30 -27.8 31.42 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 1 C-N-CA 138.496 6.719 . . . . 0.0 117.578 176.817 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -31.76 8.87 0.0 OUTLIER 'General case' 0 N--CA 1.536 3.854 0 C-N-CA 130.992 3.717 . . . . 0.0 117.045 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.497 ' H ' ' C ' ' A' ' 533' ' ' ASN . 45.5 mt -63.76 -26.84 68.82 Favored 'General case' 0 C--N 1.283 -2.295 0 N-CA-C 103.167 -2.901 . . . . 0.0 103.167 162.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.637 ' NH1' ' HA ' ' A' ' 530' ' ' VAL . 1.4 ttp180 -56.27 -39.55 72.81 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 111.887 -2.415 . . . . 0.0 110.985 169.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -60.96 -47.04 88.28 Favored 'General case' 0 CA--C 1.481 -1.706 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 -179.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.472 ' O ' HD13 ' A' ' 542' ' ' LEU . 24.4 m -55.81 -48.15 75.91 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 114.295 -1.32 . . . . 0.0 109.832 174.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . 0.552 ' O ' ' HB2' ' A' ' 542' ' ' LEU . 9.3 tt -60.54 -36.71 79.09 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . 0.484 HG12 ' O ' ' A' ' 536' ' ' ARG . 50.1 mm -66.88 -34.27 68.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 178.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . 0.443 ' HB3' ' O ' ' A' ' 538' ' ' THR . 29.7 t -57.32 -40.01 77.0 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.104 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.552 ' HB2' ' O ' ' A' ' 539' ' ' LEU . 6.3 mp -60.58 -33.63 73.0 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.527 0.731 . . . . 0.0 109.955 175.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -80.08 -31.11 39.36 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -69.71 -33.65 72.8 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -64.01 114.05 3.88 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.256 170.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -107.1 138.22 43.68 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.247 -175.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.558 ' H ' HD23 ' A' ' 547' ' ' LEU . 2.1 pt? -79.8 9.5 5.15 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.288 1.042 . . . . 0.0 110.511 177.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -68.81 -41.41 78.69 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.703 -1.135 . . . . 0.0 108.542 174.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -68.36 -60.52 2.38 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.744 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -125.21 119.78 25.12 Favored Pre-proline 0 N--CA 1.425 -1.723 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . 0.486 ' HB2' ' OE1' ' A' ' 553' ' ' GLU . 29.9 Cg_endo -63.49 -169.91 0.1 Allowed 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.233 2.622 . . . . 0.0 114.065 -177.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . 0.443 ' O ' HG13 ' A' ' 556' ' ' ILE . 47.1 p90 -91.55 -13.65 31.68 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -170.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . 0.486 ' OE1' ' HB2' ' A' ' 551' ' ' PRO . 2.0 mp0 -66.9 -42.86 84.75 Favored 'General case' 0 C--N 1.28 -2.435 0 CA-C-O 121.304 0.573 . . . . 0.0 110.416 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.9 p-10 -69.16 -24.07 64.03 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.551 175.121 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 551' ' ' PRO . 54.9 mt-10 -72.39 -46.78 53.72 Favored 'General case' 0 C--O 1.211 -0.927 0 C-N-CA 120.054 -0.658 . . . . 0.0 109.408 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 552' ' ' TYR . 64.8 mt -58.79 -49.17 83.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.116 0.566 . . . . 0.0 110.865 178.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -60.31 -52.53 64.88 Favored 'General case' 0 CA--C 1.508 -0.638 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.58 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -60.24 -43.35 96.17 Favored 'General case' 0 C--O 1.207 -1.161 0 O-C-N 123.862 0.726 . . . . 0.0 110.611 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . 0.442 ' O ' HG13 ' A' ' 563' ' ' ILE . 50.4 t80 -54.43 -53.56 52.47 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 124.473 1.109 . . . . 0.0 110.813 176.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.9 t -65.21 -42.33 93.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.569 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -62.4 -42.43 99.42 Favored 'General case' 0 C--O 1.194 -1.861 0 C-N-CA 123.456 0.702 . . . . 0.0 110.087 -179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . 0.585 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 40.9 t -64.89 -41.21 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 CA-C-O 121.656 0.741 . . . . 0.0 112.679 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.572 ' HA ' ' HG3' ' A' ' 469' ' ' GLN . 54.1 mt -76.32 -35.85 28.3 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.224 0 CA-C-O 122.136 0.969 . . . . 0.0 109.462 -174.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -90.93 -6.82 53.58 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.0 -176.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 11.8 pt-20 -76.6 -25.03 53.48 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt . . . . . 0 C--N 1.322 -0.624 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.325 176.661 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 50.5 mt . . . . . 0 C--O 1.238 0.452 0 CA-C-O 121.027 0.441 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 68.8 p -75.05 178.64 5.51 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.125 -175.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . 0.463 ' NH2' HG22 ' A' ' 562' ' ' VAL . 8.1 ptm85 -60.18 -40.94 91.77 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.54 ' NE2' ' HA ' ' A' ' 563' ' ' ILE . 67.0 mt-30 -70.36 -30.02 66.84 Favored 'General case' 0 C--O 1.212 -0.88 0 C-N-CA 119.041 -1.064 . . . . 0.0 111.429 176.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.533 ' HG2' HG22 ' A' ' 500' ' ' THR . 48.5 mt-10 -70.72 -35.19 72.61 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 120.777 0.323 . . . . 0.0 111.104 176.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.489 ' HD3' ' HA ' ' A' ' 471' ' ' LYS . 20.5 mmtp -66.93 -33.45 75.61 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.834 173.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.0 -47.17 60.35 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.91 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . 0.404 ' OE2' HG21 ' A' ' 494' ' ' VAL . 5.0 mm-40 -61.44 -44.44 97.1 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 120.515 0.198 . . . . 0.0 110.617 176.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.497 ' NE ' ' HB3' ' A' ' 542' ' ' LEU . 11.7 tpt180 -54.88 -42.23 71.84 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.778 173.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . 0.455 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . . . -64.43 -44.93 89.64 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-O 120.799 0.333 . . . . 0.0 110.692 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.24 -18.69 64.78 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.2 mt -71.08 -15.96 62.55 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 121.953 -0.467 . . . . 0.0 112.07 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.455 ' HE3' ' HA ' ' A' ' 475' ' ' ALA . 10.0 mtmp? -77.78 26.15 0.19 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 122.984 0.514 . . . . 0.0 111.747 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 -86.88 14.0 8.03 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 122.881 0.472 . . . . 0.0 111.959 -175.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 97.1 mt 71.35 -174.55 0.17 Allowed 'General case' 0 C--O 1.245 0.863 0 C-N-CA 123.754 0.821 . . . . 0.0 110.729 -177.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 59.0 ttp -88.26 -36.31 16.79 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.86 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 25.2 ttp180 -57.48 -46.67 83.43 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.914 1.286 . . . . 0.0 114.313 -173.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.3 59.29 0.27 Allowed 'General case' 0 C--N 1.28 -2.422 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -171.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -57.55 -36.76 72.06 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 124.319 1.047 . . . . 0.0 111.54 177.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -57.19 -44.05 83.24 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.117 0.484 . . . . 0.0 109.702 176.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 28.9 m -64.6 -31.63 72.93 Favored 'General case' 0 N--CA 1.421 -1.911 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.231 -178.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -61.03 -50.93 71.33 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . 0.467 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 76.1 mt -74.33 -36.75 63.68 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.514 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -61.32 -42.96 99.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.276 0.63 . . . . 0.0 112.431 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -78.57 -38.58 39.91 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.636 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -55.19 -49.28 72.31 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.82 178.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 12.6 pt-20 -79.29 -7.69 58.49 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -177.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 68.9 m -81.4 -14.88 56.65 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 122.121 0.962 . . . . 0.0 109.132 174.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . 0.578 HG13 ' HB2' ' A' ' 497' ' ' ASP . 33.1 t -100.08 133.78 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.376 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -149.5 -56.63 0.19 Allowed 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -88.46 -22.38 23.71 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 122.727 1.251 . . . . 0.0 108.347 178.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . 0.578 ' HB2' HG13 ' A' ' 494' ' ' VAL . 0.0 OUTLIER -72.96 -2.88 22.73 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 126.689 1.996 . . . . 0.0 109.365 178.191 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -77.68 22.51 0.26 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.147 0.979 . . . . 0.0 109.855 -176.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . 0.476 ' HE1' ' OE1' ' A' ' 469' ' ' GLN . 31.5 p90 -77.68 -9.75 59.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . 0.533 HG22 ' HG2' ' A' ' 470' ' ' GLU . 1.1 p -54.48 166.97 0.37 Allowed 'General case' 0 N--CA 1.426 -1.661 0 C-N-CA 125.999 1.72 . . . . 0.0 115.115 -173.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.453 ' HB2' ' OE2' ' A' ' 470' ' ' GLU . 16.0 t-20 -64.38 146.99 53.57 Favored 'General case' 0 N--CA 1.429 -1.511 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.024 -175.042 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -64.05 -15.43 59.47 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-O 120.97 0.414 . . . . 0.0 111.306 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . 0.695 ' CE1' ' HG ' ' A' ' 535' ' ' LEU . 4.2 m-70 -65.54 -39.03 91.28 Favored 'General case' 0 C--O 1.203 -1.36 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.448 176.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -63.89 -36.62 84.54 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.508 0.67 . . . . 0.0 110.32 176.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -68.11 -41.33 81.91 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.783 176.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . 0.459 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -60.81 -40.37 92.45 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.19 177.29 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . 0.464 ' O ' HD13 ' A' ' 511' ' ' LEU . 77.1 t -56.42 -56.47 13.48 Favored 'Isoleucine or valine' 0 C--N 1.341 0.217 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 173.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -45.62 -52.53 10.54 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 123.96 0.787 . . . . 0.0 111.747 174.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.47 -60.09 4.17 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 123.812 0.845 . . . . 0.0 112.539 -177.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 506' ' ' TYR . 17.0 t -60.78 -43.71 95.9 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 CA-C-O 120.512 0.196 . . . . 0.0 110.99 -176.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.464 HD13 ' O ' ' A' ' 507' ' ' VAL . 10.8 mp -63.32 -49.66 73.08 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.062 -178.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -64.18 -35.9 82.29 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 123.86 0.725 . . . . 0.0 110.856 -177.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -60.98 -44.28 97.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.822 0.344 . . . . 0.0 111.523 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -74.48 -47.21 34.64 Favored 'General case' 0 C--O 1.183 -2.409 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 14.6 t80 -47.83 -37.41 13.75 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 125.674 1.59 . . . . 0.0 110.777 -179.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.56 -40.09 88.84 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -115.87 -40.6 3.31 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -172.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -106.02 -151.57 0.46 Allowed 'General case' 0 C--N 1.271 -2.83 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . 0.403 ' CG ' ' H ' ' A' ' 520' ' ' GLN . 13.7 t70 -105.17 -160.11 0.74 Allowed 'General case' 0 C--N 1.285 -2.228 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -177.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . 0.403 ' H ' ' CG ' ' A' ' 519' ' ' ASP . 88.2 mt-30 -78.04 166.86 22.3 Favored 'General case' 0 C--N 1.296 -1.753 0 C-N-CA 123.164 0.585 . . . . 0.0 112.359 -174.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -90.07 134.38 34.29 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 125.314 1.445 . . . . 0.0 111.511 -172.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.14 176.24 5.4 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.105 177.455 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . 0.601 HD13 ' H ' ' A' ' 523' ' ' ILE 0.303 0.2 OUTLIER -78.95 -14.16 13.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 119.25 -0.98 . . . . 0.0 113.379 -175.859 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 40.9 m -60.37 -36.0 77.03 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 121.228 0.537 . . . . 0.0 109.589 169.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -66.03 -43.32 87.92 Favored 'General case' 0 C--O 1.253 1.286 0 CA-C-O 122.362 1.077 . . . . 0.0 108.207 176.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.465 ' O ' ' HD3' ' A' ' 536' ' ' ARG . . . -56.15 -52.54 64.01 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 113.675 -1.602 . . . . 0.0 111.658 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.694 ' O ' HG12 ' A' ' 530' ' ' VAL . 8.0 p -64.46 -30.67 50.83 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.928 0 CA-C-O 120.546 0.212 . . . . 0.0 111.026 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 81.3 mm-40 -66.83 -22.94 65.99 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.404 -0.81 . . . . 0.0 110.474 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.14 -3.18 41.18 Favored 'General case' 0 N--CA 1.441 -0.916 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 174.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.694 HG12 ' O ' ' A' ' 527' ' ' VAL 0.267 8.9 p -74.67 53.84 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.553 0 CA-C-O 122.918 1.342 . . . . 0.0 113.267 179.039 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -107.16 -33.99 7.27 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 14.7 t -91.77 109.23 20.55 Favored 'General case' 0 N--CA 1.421 -1.893 0 N-CA-C 102.278 -3.23 . . . . 0.0 102.278 163.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 20.5 m120 -62.62 -68.2 0.35 Allowed 'General case' 0 C--O 1.203 -1.369 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 -170.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -37.44 23.71 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 114.398 1.259 . . . . 0.0 114.398 -177.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.695 ' HG ' ' CE1' ' A' ' 503' ' ' HIS . 6.6 tt -62.06 -68.01 0.36 Allowed 'General case' 0 C--O 1.266 1.928 0 C-N-CA 124.19 0.996 . . . . 0.0 109.897 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.465 ' HD3' ' O ' ' A' ' 526' ' ' ALA . 3.7 tpm_? -69.86 -31.29 69.05 Favored 'General case' 0 N--CA 1.412 -2.33 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.843 -175.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -56.06 -58.34 8.35 Favored 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.9 0.75 . . . . 0.0 110.056 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 75.5 m -56.38 -49.04 75.58 Favored 'General case' 0 N--CA 1.443 -0.808 0 O-C-N 123.484 0.49 . . . . 0.0 111.018 178.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 20.1 tp -62.73 -32.81 74.0 Favored 'General case' 0 CA--C 1.568 1.648 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.837 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 24.1 mm -68.39 -41.39 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 174.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 19.5 m -55.35 -48.65 73.91 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.593 0.711 . . . . 0.0 109.597 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.497 ' HB3' ' NE ' ' A' ' 474' ' ' ARG . 7.8 mp -66.5 -19.69 65.85 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.112 178.07 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -87.89 -35.34 17.78 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 122.766 0.426 . . . . 0.0 111.927 175.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -69.46 -40.51 77.1 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.163 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -72.06 115.92 11.85 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 121.552 0.691 . . . . 0.0 111.591 173.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -98.31 93.67 6.34 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.607 -172.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 6.6 mp -83.0 -17.22 44.15 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.775 177.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -77.16 9.17 3.25 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -176.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -69.84 -21.99 63.32 Favored 'General case' 0 CA--C 1.495 -1.149 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 168.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -88.11 121.49 70.5 Favored Pre-proline 0 N--CA 1.411 -2.395 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.02 105.54 0.17 Allowed 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.151 1.901 . . . . 0.0 108.623 173.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . 0.655 ' HB2' ' HB3' ' A' ' 555' ' ' GLU . 4.2 p90 -77.25 40.11 0.26 Allowed 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 -168.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.82 -48.04 64.56 Favored 'General case' 0 C--N 1.266 -3.046 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.603 -179.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -69.07 -27.22 65.43 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . 0.655 ' HB3' ' HB2' ' A' ' 552' ' ' TYR . 29.6 tt0 -68.85 -38.39 79.76 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.237 -177.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . 0.593 HG13 ' O ' ' A' ' 552' ' ' TYR . 62.5 mt -64.52 -45.57 95.26 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.332 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 176.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -59.57 -43.24 93.67 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 120.887 0.375 . . . . 0.0 110.686 178.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . 0.571 ' O ' HG23 ' A' ' 562' ' ' VAL . 27.5 t70 -62.54 -55.24 29.2 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.812 175.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . 0.437 ' O ' HG12 ' A' ' 563' ' ' ILE . 40.6 t80 -48.28 -53.02 18.73 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 125.426 1.49 . . . . 0.0 110.759 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 48.6 t -55.99 -50.98 66.32 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.798 0 O-C-N 124.04 0.837 . . . . 0.0 109.524 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.546 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 3.8 t-20 -57.95 -42.77 85.64 Favored 'General case' 0 C--O 1.193 -1.915 0 CA-C-N 117.788 0.267 . . . . 0.0 110.812 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 558' ' ' ASP . 99.1 t -62.47 -36.39 74.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 C-N-CA 124.031 0.933 . . . . 0.0 112.403 -178.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.54 ' HA ' ' NE2' ' A' ' 469' ' ' GLN . 50.8 mm -88.08 -41.86 14.58 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.929 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 -173.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 66.3 t30 -85.38 18.02 2.88 Favored 'General case' 0 N--CA 1.423 -1.789 0 CA-C-N 112.946 -1.934 . . . . 0.0 110.274 -176.534 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.546 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 51.6 mt-10 -72.65 -16.05 61.71 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.199 -2.149 . . . . 0.0 105.199 165.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 59.8 mttp . . . . . 0 CA--C 1.543 0.683 0 CA-C-N 113.444 -1.707 . . . . 0.0 109.942 174.088 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 84.0 mt . . . . . 0 N--CA 1.426 -1.649 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 12.9 m -60.75 176.65 0.37 Allowed 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -170.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -54.73 -17.63 3.69 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.684 1.993 . . . . 0.0 113.214 -175.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -53.07 -44.84 67.8 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 123.188 0.305 . . . . 0.0 110.986 177.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 38.1 tt0 -66.31 -30.76 71.24 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 119.511 -0.876 . . . . 0.0 111.046 -178.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . 0.462 ' HD3' HH21 ' A' ' 474' ' ' ARG . 27.8 tptp -64.62 -33.01 74.93 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.591 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -67.8 -44.86 76.37 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . 0.434 ' HB3' ' CE2' ' A' ' 504' ' ' PHE . 1.4 mp0 -56.64 -46.16 81.16 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.074 0.464 . . . . 0.0 110.529 172.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 37.7 mtm-85 -62.81 -37.7 87.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.384 -179.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . 0.654 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -72.13 -39.2 69.0 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 120.87 0.367 . . . . 0.0 110.927 176.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -63.56 -39.51 94.59 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-O 121.682 0.753 . . . . 0.0 110.797 -179.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 25.2 tp -71.78 -17.44 62.18 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.788 -1.096 . . . . 0.0 113.67 -173.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.654 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 19.5 pttp -70.78 -11.11 60.75 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -177.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -122.93 90.79 3.36 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.629 ' HA ' ' HB2' ' A' ' 483' ' ' ASP . 4.2 tt -143.02 71.22 1.33 Allowed 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.781 0.8 . . . . 0.0 109.266 177.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 65.0 mtt -97.15 -88.73 0.29 Allowed 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.561 177.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -72.31 -9.06 58.0 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.276 1.431 . . . . 0.0 109.616 174.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . 0.629 ' HB2' ' HA ' ' A' ' 480' ' ' LEU . 5.5 m-20 -69.18 37.48 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 128.411 2.685 . . . . 0.0 116.136 -166.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -53.41 -40.13 64.86 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 121.704 0.764 . . . . 0.0 109.983 172.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -60.0 -49.77 76.38 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.681 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . 0.578 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 7.1 m -59.95 -42.18 93.47 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.101 0.96 . . . . 0.0 110.773 -178.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -54.79 -51.32 66.12 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 81.1 mt -68.68 -29.7 68.2 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.4 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -68.97 -34.26 75.02 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.778 0.323 . . . . 0.0 111.134 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -85.27 -40.14 16.93 Favored 'General case' 0 N--CA 1.419 -2.014 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -67.8 -35.15 78.13 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -77.48 -21.9 52.13 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 120.871 0.367 . . . . 0.0 110.525 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 64.5 m -83.8 -8.6 59.19 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.32 0.581 . . . . 0.0 111.76 -175.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . 0.427 HG22 ' OD1' ' A' ' 498' ' ' ASN . 0.3 OUTLIER -92.97 153.44 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.638 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -176.642 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -155.26 -105.69 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -172.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . 0.431 ' C ' ' H ' ' A' ' 498' ' ' ASN . 38.8 ttpt -90.3 -37.88 13.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.453 0.644 . . . . 0.0 110.533 178.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -75.28 30.84 0.1 Allowed 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 126.04 1.736 . . . . 0.0 112.322 -174.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 496' ' ' LYS . 6.0 m-20 -73.14 36.11 0.08 Allowed 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 126.779 2.032 . . . . 0.0 111.355 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -65.79 -13.06 58.72 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.258 -178.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 15.9 m -55.15 149.84 11.73 Favored 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 124.418 1.087 . . . . 0.0 108.743 173.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -65.58 155.23 36.42 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.615 -0.678 . . . . 0.0 112.032 -174.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -66.64 5.92 0.54 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.135 0.493 . . . . 0.0 111.894 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . 0.483 ' O ' HG23 ' A' ' 507' ' ' VAL . 1.5 m-70 -54.51 -51.78 64.04 Favored 'General case' 0 C--O 1.203 -1.353 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 172.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . 0.434 ' CE2' ' HB3' ' A' ' 473' ' ' GLU . 94.2 m-85 -65.15 -27.3 68.63 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.967 -1.015 . . . . 0.0 113.182 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -68.14 -44.23 76.5 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -38.5 89.13 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 119.787 -0.765 . . . . 0.0 109.677 177.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 503' ' ' HIS . 22.1 t -62.18 -47.11 94.66 Favored 'Isoleucine or valine' 0 C--N 1.354 0.778 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -47.78 -45.72 29.67 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.697 0.799 . . . . 0.0 111.235 173.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -60.05 -53.19 60.71 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.445 -179.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 18.5 t -58.87 -48.1 87.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 123.406 0.442 . . . . 0.0 109.945 178.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 97.1 mt -54.46 -56.53 17.78 Favored 'General case' 0 C--O 1.211 -0.971 0 O-C-N 124.067 0.854 . . . . 0.0 110.545 -178.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -60.3 -30.96 69.83 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 123.996 0.918 . . . . 0.0 110.774 -177.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.49 -46.66 66.09 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.597 -178.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . 0.251 11.2 p90 -82.83 -28.61 30.05 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 119.399 -0.92 . . . . 0.0 111.049 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -51.71 -35.67 43.9 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.802 1.241 . . . . 0.0 108.779 174.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -59.47 -28.83 67.35 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.036 -0.983 . . . . 0.0 111.234 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -103.36 -59.57 1.69 Allowed 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.485 179.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -157.38 122.18 4.43 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -90.87 96.95 10.89 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -174.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -142.27 124.23 15.29 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 161.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -67.97 129.24 39.31 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 119.45 1.023 . . . . 0.0 110.497 179.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -113.35 132.24 55.66 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.405 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 35.4 pt -78.47 -13.03 13.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.186 0 CA-C-O 121.17 0.51 . . . . 0.0 110.484 -177.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . 0.555 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 33.1 t -58.17 -41.01 82.92 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.373 174.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -65.55 -35.86 82.08 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 108.901 -0.778 . . . . 0.0 108.901 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -60.71 -50.32 73.94 Favored 'General case' 0 C--O 1.213 -0.833 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.311 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 11.9 p -71.17 -18.02 20.27 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.868 -0.52 . . . . 0.0 111.006 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.4 mm100 -68.04 -39.78 83.0 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 170.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.52 ' CB ' ' HG3' ' A' ' 536' ' ' ARG . 8.1 m-85 -72.36 13.9 0.29 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.146 1.378 . . . . 0.0 112.894 176.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.758 ' HA ' ' NH2' ' A' ' 536' ' ' ARG . 8.7 p -72.74 18.4 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.592 2.585 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -129.16 -49.27 1.2 Allowed 'General case' 0 N--CA 1.479 0.991 0 O-C-N 120.953 -1.092 . . . . 0.0 109.714 176.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 27.4 t -76.04 -144.42 0.02 OUTLIER 'General case' 0 CA--C 1.578 2.036 0 C-N-CA 126.806 2.042 . . . . 0.0 112.349 -176.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . 0.481 ' C ' ' H ' ' A' ' 535' ' ' LEU . 2.0 t-20 -28.45 30.42 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.978 1 C-N-CA 138.831 6.853 . . . . 0.0 117.419 179.072 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -32.32 9.92 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.221 1 C-N-CA 131.762 4.025 . . . . 0.0 116.891 179.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.481 ' H ' ' C ' ' A' ' 533' ' ' ASN . 40.9 mt -63.51 -29.36 70.64 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 102.474 -3.158 . . . . 0.0 102.474 162.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.758 ' NH2' ' HA ' ' A' ' 530' ' ' VAL . 0.4 OUTLIER -54.27 -36.92 64.13 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 111.897 -2.411 . . . . 0.0 110.279 170.617 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -72.22 -37.24 69.24 Favored 'General case' 0 CA--C 1.483 -1.611 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -175.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 5.9 m -59.64 -40.98 89.44 Favored 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 118.837 -1.145 . . . . 0.0 108.965 170.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 63.8 tp -59.99 -34.51 73.42 Favored 'General case' 0 C--O 1.215 -0.734 0 O-C-N 121.619 -0.676 . . . . 0.0 111.676 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 53.0 mt -61.97 -35.12 66.49 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 5.5 p -58.3 -43.96 88.34 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 8.2 mp -64.78 -41.15 96.07 Favored 'General case' 0 N--CA 1.487 1.42 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.175 176.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -61.97 -35.42 78.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.173 0.989 . . . . 0.0 108.85 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . 0.494 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 53.4 tt0 -74.05 39.97 0.12 Allowed 'General case' 0 CA--C 1.567 1.606 0 CA-C-O 122.656 1.217 . . . . 0.0 111.209 177.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -75.05 157.08 35.41 Favored 'General case' 0 C--N 1.279 -2.47 0 O-C-N 120.949 -1.095 . . . . 0.0 111.086 177.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -102.73 -178.01 3.55 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.717 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.606 ' O ' ' HG3' ' A' ' 550' ' ' GLU . 92.2 mt -76.27 18.96 0.26 Allowed 'General case' 0 C--O 1.208 -1.111 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -173.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . 0.487 ' O ' ' HD2' ' A' ' 552' ' ' TYR . 31.3 p-10 -75.02 -8.5 56.71 Favored 'General case' 0 C--N 1.317 -0.836 0 O-C-N 121.934 -0.479 . . . . 0.0 110.974 179.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -70.15 0.86 5.45 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.927 0.891 . . . . 0.0 112.35 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.606 ' HG3' ' O ' ' A' ' 547' ' ' LEU . 45.8 mt-10 -55.08 133.35 68.29 Favored Pre-proline 0 C--O 1.239 0.544 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_exo 5.16 61.01 0.0 OUTLIER 'Trans proline' 0 C--N 1.376 1.994 1 C-N-CA 126.843 5.029 . . . . 0.0 115.878 -166.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . 0.62 ' O ' ' HG3' ' A' ' 555' ' ' GLU . 1.6 t80 -99.83 21.17 12.94 Favored 'General case' 0 C--O 1.205 -1.248 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 -175.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -68.35 11.1 0.18 Allowed 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -174.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . 0.55 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 6.9 t30 -75.18 -20.6 59.23 Favored 'General case' 0 C--O 1.17 -3.098 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 171.184 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . 0.62 ' HG3' ' O ' ' A' ' 552' ' ' TYR . 51.3 mt-10 -35.49 -46.04 0.37 Allowed 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 114.517 1.302 . . . . 0.0 114.517 -176.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 59.5 mt -58.78 -38.48 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 CA-C-N 118.28 0.491 . . . . 0.0 110.714 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . 0.55 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 3.4 t70 -59.54 -54.59 44.76 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.984 0.914 . . . . 0.0 108.808 176.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . 0.605 ' O ' HG23 ' A' ' 562' ' ' VAL . 12.8 m-20 -58.52 -53.92 52.83 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.006 177.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . 0.536 ' O ' HD13 ' A' ' 563' ' ' ILE . 63.3 t80 -51.86 -53.28 42.27 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 126.815 2.046 . . . . 0.0 111.881 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 49.3 t -59.84 -41.39 85.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . 0.624 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 8.0 t30 -60.89 -59.73 4.92 Favored 'General case' 0 C--O 1.193 -1.906 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.558 175.227 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 558' ' ' ASP . 60.1 t -55.07 -36.98 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 C-N-CA 124.074 0.949 . . . . 0.0 112.714 -172.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.536 HD13 ' O ' ' A' ' 559' ' ' TYR . 1.6 mp -80.15 -40.61 20.35 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.544 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.917 -172.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -95.45 7.09 47.25 Favored 'General case' 0 N--CA 1.416 -2.167 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.869 -176.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.624 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 52.5 mt-10 -71.67 -23.68 61.71 Favored 'General case' 0 C--N 1.368 1.391 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 170.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 62.5 tttm . . . . . 0 CA--C 1.557 1.224 0 CA-C-N 113.902 -1.499 . . . . 0.0 114.324 -176.453 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 92.2 mt . . . . . 0 N--CA 1.432 -1.332 0 CA-C-O 121.36 0.6 . . . . 0.0 110.916 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 39.7 m -101.76 127.86 48.35 Favored 'General case' 0 C--N 1.278 -2.502 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 468' ' ' ARG . . . . . 0.524 ' HB2' HG13 ' A' ' 562' ' ' VAL . 88.4 mtm180 -62.74 -12.77 26.11 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -177.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 469' ' ' GLN . . . . . 0.461 ' O ' ' HG3' ' A' ' 473' ' ' GLU . 24.6 mt-30 -40.99 -49.55 3.29 Favored 'General case' 0 C--O 1.206 -1.185 0 C-N-CA 125.479 1.511 . . . . 0.0 114.156 -177.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -68.74 -31.81 71.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.953 0.406 . . . . 0.0 111.039 -174.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 22.8 tptp -74.76 -29.81 61.26 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 472' ' ' ALA . . . . . 0.537 ' HB2' HG11 ' A' ' 562' ' ' VAL . . . -69.82 -47.92 60.97 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 174.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . 0.483 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 57.7 mt-10 -49.81 -49.57 48.32 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.64 0.776 . . . . 0.0 109.488 173.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 474' ' ' ARG . . . . . 0.55 ' HG3' ' CD2' ' A' ' 542' ' ' LEU . 11.1 tpp85 -46.79 -60.89 2.12 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 125.261 1.424 . . . . 0.0 109.657 -178.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 475' ' ' ALA . . . . . 0.533 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -68.53 -36.01 78.26 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-N 115.289 -0.868 . . . . 0.0 112.445 -177.132 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -33.54 74.69 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.332 0.586 . . . . 0.0 112.079 -177.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 477' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 94.0 mt -73.47 -8.84 57.57 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -176.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 478' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 63.3 pttt -76.5 6.38 5.86 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.917 -0.49 . . . . 0.0 110.993 -178.133 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 10.4 t-80 -77.75 23.94 0.23 Allowed 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 123.741 0.816 . . . . 0.0 112.729 -172.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 480' ' ' LEU . . . . . 0.4 HD12 ' H ' ' A' ' 482' ' ' ARG 0.29 2.7 pp 49.76 -158.8 0.07 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.629 1.572 . . . . 0.0 114.798 177.165 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 481' ' ' MET . . . . . 0.469 ' C ' ' H ' ' A' ' 483' ' ' ASP . 46.9 ttm -66.7 6.95 0.41 Allowed 'General case' 0 CA--C 1.569 1.695 0 CA-C-O 122.569 1.175 . . . . 0.0 113.648 -174.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 482' ' ' ARG . . . . . 0.4 ' H ' HD12 ' A' ' 480' ' ' LEU . 26.7 mmt180 -74.69 11.1 1.12 Allowed 'General case' 0 C--O 1.248 0.998 0 C-N-CA 123.899 0.88 . . . . 0.0 110.153 167.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 483' ' ' ASP . . . . . 0.469 ' H ' ' C ' ' A' ' 481' ' ' MET . 9.5 p-10 -68.81 1.0 3.65 Favored 'General case' 0 C--O 1.201 -1.478 0 C-N-CA 126.231 1.812 . . . . 0.0 113.608 -169.304 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -72.28 -60.37 2.26 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.54 -53.52 56.59 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.544 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 86.1 m -59.44 -37.97 79.49 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.786 -178.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 487' ' ' PHE . . . . . 0.415 ' HB2' ' O ' ' A' ' 483' ' ' ASP . 46.7 t80 -56.15 -58.02 9.73 Favored 'General case' 0 C--O 1.205 -1.269 0 C-N-CA 120.419 -0.513 . . . . 0.0 110.158 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 5.9 mp -72.29 -31.91 66.13 Favored 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 119.454 -0.898 . . . . 0.0 111.364 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -68.26 -41.06 81.67 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.932 0.396 . . . . 0.0 111.32 -177.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -85.28 -35.41 21.53 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.546 -178.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -58.26 -46.36 86.15 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 122.873 0.469 . . . . 0.0 112.259 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -81.65 -15.58 54.12 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -177.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 73.4 m -80.98 -28.42 35.56 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -178.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 11.8 t -98.52 152.3 4.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -152.23 -39.58 0.11 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.693 0.759 . . . . 0.0 110.27 -178.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -82.44 18.7 1.4 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.938 178.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 497' ' ' ASP . . . . . 0.742 ' O ' ' HB3' ' A' ' 501' ' ' ASN . 7.6 p-10 -65.93 -19.51 65.89 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 123.837 0.855 . . . . 0.0 110.78 -178.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . 0.437 ' HA ' ' ND2' ' A' ' 501' ' ' ASN . 6.9 t-20 -72.88 15.45 0.2 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.751 1.22 . . . . 0.0 114.023 -165.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -75.65 -71.95 0.34 Allowed 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 26.0 m -127.36 93.36 3.71 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 170.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 501' ' ' ASN . . . . . 0.742 ' HB3' ' O ' ' A' ' 497' ' ' ASP . 34.8 p-10 -127.14 46.33 2.54 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -169.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 18.3 pm0 -73.17 -25.29 60.74 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.319 -0.952 . . . . 0.0 108.485 173.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 503' ' ' HIS . . . . . 0.436 ' O ' HG23 ' A' ' 507' ' ' VAL . 38.3 t-80 -62.64 -64.49 0.9 Allowed 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.218 175.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -55.74 -38.48 69.85 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 124.025 0.93 . . . . 0.0 110.639 -179.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -64.88 -52.02 58.82 Favored 'General case' 0 CA--C 1.5 -0.943 0 C-N-CA 123.079 0.552 . . . . 0.0 109.595 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -62.61 -41.67 99.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 507' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 503' ' ' HIS . 67.0 t -62.36 -52.96 53.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.714 178.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -49.64 -53.06 26.41 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 124.534 1.146 . . . . 0.0 111.838 176.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -56.79 -62.63 1.6 Allowed 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.321 0.648 . . . . 0.0 112.185 -177.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 48.6 t -59.69 -45.85 93.98 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.665 0 O-C-N 123.692 0.62 . . . . 0.0 110.944 -176.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 3.2 tt -69.23 -49.08 59.66 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.955 -172.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -67.76 -29.52 68.75 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.185 -176.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -64.43 -49.23 72.33 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.244 0.545 . . . . 0.0 110.434 178.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -70.48 -55.25 9.4 Favored 'General case' 0 C--O 1.198 -1.627 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.232 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -52.67 -36.32 56.74 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -178.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -77.6 -19.38 55.67 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.34 -45.6 2.92 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 122.111 0.958 . . . . 0.0 110.018 -172.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 39.0 t-20 -112.38 -154.34 0.54 Allowed 'General case' 0 C--N 1.286 -2.169 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 519' ' ' ASP . . . . . 0.406 ' HB3' ' H ' ' A' ' 520' ' ' GLN . 9.1 m-20 -83.82 -160.24 0.43 Allowed 'General case' 0 C--N 1.308 -1.221 0 C-N-CA 123.468 0.707 . . . . 0.0 109.878 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 520' ' ' GLN . . . . . 0.555 ' NE2' ' H ' ' A' ' 520' ' ' GLN . 0.0 OUTLIER -62.62 177.12 0.56 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.617 0.767 . . . . 0.0 110.257 178.265 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -88.11 148.81 24.27 Favored 'General case' 1 N--CA 1.37 -4.449 0 O-C-N 121.543 -0.723 . . . . 0.0 109.638 -175.242 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 522' ' ' ASN . . . . . 0.493 ' HB3' ' OD2' ' A' ' 525' ' ' ASP . 52.0 t30 -116.11 154.64 29.6 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.466 0.65 . . . . 0.0 111.313 -174.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -37.21 78.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 C-N-CA 124.776 1.23 . . . . 0.0 110.7 -178.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 39.0 t -57.1 -33.01 66.88 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.956 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 525' ' ' ASP . . . . . 0.493 ' OD2' ' HB3' ' A' ' 522' ' ' ASN . 12.0 m-20 -61.1 -40.69 94.7 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.303 0.573 . . . . 0.0 110.0 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 526' ' ' ALA . . . . . 0.47 ' HA ' ' HD3' ' A' ' 536' ' ' ARG . . . -63.57 -43.17 97.79 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.243 178.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 527' ' ' VAL . . . . . 0.495 ' O ' HG22 ' A' ' 530' ' ' VAL . 96.9 t -64.63 -35.34 74.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 C-N-CA 125.033 1.333 . . . . 0.0 110.805 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -66.74 -34.63 78.26 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.43 0.634 . . . . 0.0 109.595 175.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.605 ' HB3' ' HD2' ' A' ' 536' ' ' ARG . 1.1 t80 -77.28 2.62 15.11 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 -178.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 530' ' ' VAL . . . . . 0.495 HG22 ' O ' ' A' ' 527' ' ' VAL . 14.7 m -74.69 15.0 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -176.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -109.03 -36.22 6.13 Favored 'General case' 0 C--N 1.285 -2.228 0 C-N-CA 119.458 -0.897 . . . . 0.0 108.644 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 532' ' ' SER . . . . . 0.495 ' C ' ' H ' ' A' ' 534' ' ' GLU . 26.3 t -81.44 -143.16 0.05 OUTLIER 'General case' 0 C--N 1.29 -2.019 0 C-N-CA 125.63 1.572 . . . . 0.0 107.673 173.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 533' ' ' ASN . . . . . 0.463 ' C ' ' H ' ' A' ' 535' ' ' LEU 0.386 17.2 m120 -35.14 29.08 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.986 1 C-N-CA 132.926 4.49 . . . . 0.0 118.764 171.607 . . . . . . . . 4 3 . 1 . 020 nuclear nobuild core ' A' A ' 534' ' ' GLU . . . . . 0.495 ' H ' ' C ' ' A' ' 532' ' ' SER . 9.6 pt-20 -34.63 8.04 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 130.515 3.526 . . . . 0.0 116.008 177.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 535' ' ' LEU . . . . . 0.463 ' H ' ' C ' ' A' ' 533' ' ' ASN . 3.3 pp -67.77 -21.36 65.26 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 162.179 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 536' ' ' ARG . . . . . 0.605 ' HD2' ' HB3' ' A' ' 529' ' ' TYR . 28.0 ttm-85 -66.56 -24.86 66.42 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.676 -1.602 . . . . 0.0 110.445 171.191 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . 0.45 ' HA ' HD12 ' A' ' 540' ' ' ILE . 2.4 tm-20 -75.34 -39.2 59.63 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 538' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 541' ' ' SER . 8.9 m -57.7 -42.23 83.29 Favored 'General case' 0 CA--C 1.563 1.48 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.45 173.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.07 -43.09 91.71 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.031 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 540' ' ' ILE . . . . . 0.566 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 75.2 mt -57.29 -40.51 74.35 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.256 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 541' ' ' SER . . . . . 0.414 ' HB2' ' O ' ' A' ' 538' ' ' THR . 26.4 m -56.31 -38.79 71.75 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 120.934 0.397 . . . . 0.0 111.339 177.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 542' ' ' LEU . . . . . 0.615 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 8.3 mp -69.59 -24.8 63.73 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 120.801 0.334 . . . . 0.0 111.644 174.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -75.44 -38.64 59.6 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 544' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 540' ' ' ILE . 74.7 mm-40 -79.5 33.63 0.25 Allowed 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 125.763 1.625 . . . . 0.0 110.481 177.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 545' ' ' TYR . . . . . 0.615 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 8.6 p90 -65.12 154.49 37.76 Favored 'General case' 0 N--CA 1.404 -2.77 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -169.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -83.6 -176.19 6.18 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.497 -1.228 . . . . 0.0 109.017 -174.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 547' ' ' LEU . . . . . 0.421 ' C ' ' H ' ' A' ' 549' ' ' ASP . 2.2 pp -69.45 17.54 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -174.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -73.96 22.43 0.09 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.251 1.821 . . . . 0.0 111.782 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 549' ' ' ASP . . . . . 0.421 ' H ' ' C ' ' A' ' 547' ' ' LEU . 28.5 t70 -72.12 -6.79 45.05 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 124.008 0.923 . . . . 0.0 112.19 -177.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 550' ' ' GLU . . . . . 0.409 ' HB2' ' HD2' ' A' ' 551' ' ' PRO . 1.0 OUTLIER -59.43 158.91 18.6 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-O 119.313 -0.375 . . . . 0.0 110.266 -177.629 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 551' ' ' PRO . . . . . 0.409 ' HD2' ' HB2' ' A' ' 550' ' ' GLU . 20.0 Cg_endo -59.7 72.99 0.06 OUTLIER 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 122.86 2.373 . . . . 0.0 115.105 -179.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -100.67 9.7 42.11 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 173.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.35 14.2 0.1 Allowed 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 113.408 -1.724 . . . . 0.0 113.934 -174.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 554' ' ' ASN . . . . . 0.546 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 3.9 t30 -68.5 -19.98 64.56 Favored 'General case' 0 C--O 1.192 -1.953 0 N-CA-C 104.12 -2.548 . . . . 0.0 104.12 165.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -33.46 -42.06 0.09 Allowed 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 127.528 2.331 . . . . 0.0 111.783 168.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 21.9 mm -62.02 -44.3 98.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 109.425 -0.584 . . . . 0.0 109.425 177.468 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 557' ' ' ASP . . . . . 0.546 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 6.4 t70 -58.64 -44.11 89.96 Favored 'General case' 0 C--O 1.25 1.112 0 C-N-CA 124.261 1.024 . . . . 0.0 110.443 176.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -68.91 -49.21 60.08 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.325 177.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 559' ' ' TYR . . . . . 0.471 ' CD1' ' HB1' ' A' ' 472' ' ' ALA . 48.4 t80 -50.25 -52.06 39.38 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.164 1.386 . . . . 0.0 111.356 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 48.4 t -62.96 -39.18 84.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.213 -179.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -61.45 -36.5 80.58 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-O 120.705 0.288 . . . . 0.0 110.514 175.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 562' ' ' VAL . . . . . 0.537 HG11 ' HB2' ' A' ' 472' ' ' ALA . 54.0 t -70.63 -33.75 54.3 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.05 0 C-N-CA 123.863 0.865 . . . . 0.0 112.905 177.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 563' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 559' ' ' TYR . 49.1 mm -84.17 -40.1 15.25 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.717 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 -176.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -79.39 -2.97 44.17 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 114.449 -1.25 . . . . 0.0 110.164 178.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 565' ' ' GLU . . . . . 0.522 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 19.1 tt0 -56.55 -35.08 67.73 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 170.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 19.9 mmtp . . . . . 0 N--CA 1.439 -1.013 0 CA-C-N 113.927 -1.488 . . . . 0.0 109.885 179.065 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 . . . . . 0 C--O 1.251 1.14 0 N-CA-C 110.054 -0.35 . . . . 0.0 110.054 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 38.4 t70 -92.15 101.66 14.18 Favored 'General case' 0 N--CA 1.418 -2.032 0 N-CA-C 107.309 -1.367 . . . . 0.0 107.309 173.49 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -114.15 56.6 0.71 Allowed 'General case' 0 C--N 1.292 -1.928 0 C-N-CA 119.943 -0.703 . . . . 0.0 109.48 -174.662 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 89.0 mt -66.6 98.08 0.49 Allowed 'General case' 0 N--CA 1.437 -1.091 0 N-CA-C 106.882 -1.525 . . . . 0.0 106.882 170.54 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . 0.446 ' HB3' ' OE1' ' A' ' 470' ' ' GLU . 33.0 t -85.46 174.66 9.34 Favored 'General case' 0 C--N 1.272 -2.795 0 CA-C-N 114.461 -1.245 . . . . 0.0 111.889 -171.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 10.0 ptm85 -65.5 -22.86 66.77 Favored 'General case' 0 C--N 1.308 -1.215 0 CA-C-N 113.611 -1.631 . . . . 0.0 110.744 176.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.496 HE21 HG23 ' A' ' 563' ' ' ILE . 51.0 mt-30 -67.27 -34.35 77.24 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 177.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.446 ' OE1' ' HB3' ' A' ' 467' ' ' SER . 2.3 mp0 -73.86 -23.2 59.58 Favored 'General case' 0 C--N 1.313 -1.002 0 CA-C-N 115.631 -0.713 . . . . 0.0 111.509 175.107 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -71.02 -33.38 70.3 Favored 'General case' 0 N--CA 1.44 -0.957 0 N-CA-C 106.168 -1.79 . . . . 0.0 106.168 174.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . 0.414 ' HB3' ' O ' ' A' ' 469' ' ' GLN . . . -67.25 -42.29 84.16 Favored 'General case' 0 N--CA 1.441 -0.884 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.492 174.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 32.6 mt-10 -51.7 -60.62 2.96 Favored 'General case' 0 N--CA 1.489 1.499 0 CA-C-O 122.37 1.081 . . . . 0.0 109.257 172.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 55.2 mtt180 -52.83 -46.34 67.73 Favored 'General case' 0 C--N 1.323 -0.577 0 CA-C-N 113.66 -1.609 . . . . 0.0 112.466 -178.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -70.89 -36.82 72.92 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 112.606 0.595 . . . . 0.0 112.606 179.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -62.95 -29.84 71.11 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 121.577 0.703 . . . . 0.0 110.57 -178.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 91.5 mt -73.23 -7.33 51.0 Favored 'General case' 0 C--N 1.313 -0.978 0 CA-C-N 115.236 -0.893 . . . . 0.0 112.968 179.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.405 ' HE2' ' O ' ' A' ' 542' ' ' LEU . 37.8 ttmt -77.17 -13.67 59.91 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 108.547 -0.908 . . . . 0.0 108.547 176.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 54.8 t60 -60.66 137.74 58.15 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 178.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 63.2 mt -51.52 123.35 9.67 Favored 'General case' 0 C--O 1.242 0.677 0 CA-C-O 122.126 0.965 . . . . 0.0 112.573 -176.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 52.4 mtt -71.74 1.26 7.12 Favored 'General case' 0 C--N 1.311 -1.098 0 CA-C-N 113.286 -1.779 . . . . 0.0 113.502 -170.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 54.2 mtt180 -68.08 -44.65 75.82 Favored 'General case' 0 C--N 1.317 -0.844 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 171.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 48.6 t0 -74.7 58.78 0.82 Allowed 'General case' 0 N--CA 1.431 -1.388 0 C-N-CA 126.485 1.914 . . . . 0.0 111.879 -174.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . 0.634 ' HE3' HD23 ' A' ' 511' ' ' LEU . 12.5 mmmm -62.14 -18.01 59.59 Favored 'General case' 0 C--N 1.307 -1.247 0 CA-C-N 114.965 -1.016 . . . . 0.0 113.346 -179.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -57.46 -39.85 77.23 Favored 'General case' 0 CA--C 1.511 -0.553 0 N-CA-C 108.679 -0.859 . . . . 0.0 108.679 171.805 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 19.8 m -60.17 -35.01 74.39 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.318 -0.855 . . . . 0.0 111.843 177.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . 0.465 ' CE1' ' HA ' ' A' ' 508' ' ' PHE . 4.9 t80 -58.62 -51.98 67.61 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-O 121.122 0.487 . . . . 0.0 110.078 174.423 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 53.9 tp -70.57 -31.48 68.53 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.809 -176.518 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -69.5 -42.11 75.2 Favored 'General case' 0 CA--C 1.509 -0.634 0 CA-C-N 116.396 -0.366 . . . . 0.0 111.007 178.289 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -76.66 -31.43 57.31 Favored 'General case' 0 N--CA 1.441 -0.903 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 -178.208 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . 0.41 ' O ' HG12 ' A' ' 494' ' ' VAL . 6.3 t80 -60.39 -51.1 70.91 Favored 'General case' 0 CA--C 1.545 0.776 0 CA-C-N 115.989 -0.551 . . . . 0.0 111.45 176.43 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 46.5 mt-10 -85.29 -12.11 53.14 Favored 'General case' 0 C--N 1.312 -1.052 0 N-CA-C 114.921 1.452 . . . . 0.0 114.921 -176.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 45.8 m -87.41 -15.16 38.57 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.634 0.731 . . . . 0.0 109.527 179.613 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . 0.41 HG12 ' O ' ' A' ' 491' ' ' TYR . 1.4 p -99.45 176.52 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.415 -2.216 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.01 -175.678 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -85.01 100.71 11.85 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.469 0.652 . . . . 0.0 111.811 179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 51.2 mtpt -65.5 -30.46 71.23 Favored 'General case' 0 C--N 1.298 -1.672 0 CA-C-N 114.589 -1.187 . . . . 0.0 109.486 178.708 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 29.0 t70 -69.8 -72.04 0.21 Allowed 'General case' 0 C--N 1.324 -0.522 0 CA-C-N 115.106 -0.952 . . . . 0.0 112.67 -178.026 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -92.12 -33.43 14.76 Favored 'General case' 0 C--O 1.215 -0.744 0 N-CA-C 113.704 1.001 . . . . 0.0 113.704 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 50.9 t80 -78.64 -7.59 57.79 Favored 'General case' 0 C--N 1.306 -1.297 0 C-N-CA 120.615 -0.434 . . . . 0.0 111.956 -171.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.3 t -60.73 108.33 0.83 Allowed 'General case' 0 CA--C 1.563 1.445 0 CA-C-O 123.299 1.523 . . . . 0.0 111.235 -179.558 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.425 ' ND2' ' HG2' ' A' ' 470' ' ' GLU . 54.2 t-20 -93.94 157.65 16.01 Favored 'General case' 0 C--N 1.29 -2.013 0 CA-C-N 113.56 -1.655 . . . . 0.0 107.679 -178.005 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -62.84 -34.04 76.51 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 122.032 0.92 . . . . 0.0 108.821 174.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 24.1 t-80 -60.18 -51.02 71.35 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.683 -1.144 . . . . 0.0 108.76 174.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -60.7 -37.64 82.35 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.337 -1.301 . . . . 0.0 110.859 178.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 3.5 tmtm? -63.65 -51.69 64.07 Favored 'General case' 0 CA--C 1.496 -1.132 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . . . . . . . . 0.256 25.8 m-85 -62.84 -42.3 99.68 Favored 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 114.406 1.262 . . . . 0.0 114.406 177.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . 0.492 ' O ' HD13 ' A' ' 511' ' ' LEU . 92.5 t -63.51 -56.7 15.47 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.654 0 C-N-CA 120.261 -0.576 . . . . 0.0 109.945 178.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . 0.465 ' HA ' ' CE1' ' A' ' 487' ' ' PHE . 13.6 t80 -49.27 -48.65 45.81 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 112.77 0.656 . . . . 0.0 112.77 177.289 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -61.73 -55.9 25.35 Favored 'General case' 0 C--N 1.309 -1.162 0 C-N-CA 123.185 0.594 . . . . 0.0 111.821 -175.209 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 42.9 t -61.62 -45.71 98.1 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.688 0.756 . . . . 0.0 110.717 -179.338 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.634 HD23 ' HE3' ' A' ' 484' ' ' LYS . 10.3 mp -67.67 -31.57 71.63 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.406 -175.612 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 13.9 t60 -72.31 -32.86 66.92 Favored 'General case' 0 C--N 1.305 -1.36 0 CA-C-N 115.724 -0.671 . . . . 0.0 110.013 176.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -63.0 -40.81 98.89 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-O 121.371 0.605 . . . . 0.0 110.231 -179.28 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 93.4 m-85 -76.3 -36.64 58.26 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.777 -0.647 . . . . 0.0 109.949 176.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . 0.6 ' HA ' ' HB2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -53.25 -34.04 55.56 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 124.269 1.027 . . . . 0.0 110.223 177.595 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.59 -18.85 62.2 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 114.946 -1.025 . . . . 0.0 113.281 179.364 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 26.6 tt0 -134.13 -57.76 0.85 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 117.686 -1.606 . . . . 0.0 113.772 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -152.03 107.02 3.25 Favored 'General case' 0 N--CA 1.485 1.279 0 N-CA-C 106.028 -1.841 . . . . 0.0 106.028 -179.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . 0.6 ' HB2' ' HA ' ' A' ' 515' ' ' TYR . 28.8 t0 -107.56 96.16 6.2 Favored 'General case' 0 C--N 1.284 -2.267 0 N-CA-C 117.718 2.488 . . . . 0.0 117.718 -163.161 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 68.9 mt-30 -141.96 126.3 17.63 Favored 'General case' 0 C--N 1.315 -0.906 0 CA-C-N 113.984 -1.462 . . . . 0.0 107.722 162.058 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 72.8 t80 -100.63 132.9 45.78 Favored 'General case' 0 C--N 1.291 -1.948 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -177.624 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -120.19 172.3 7.88 Favored 'General case' 0 N--CA 1.437 -1.087 0 N-CA-C 115.082 1.512 . . . . 0.0 115.082 -178.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . 0.523 HG13 HD12 ' A' ' 540' ' ' ILE . 0.9 OUTLIER -52.05 -46.29 42.4 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.006 0 C-N-CA 126.803 2.041 . . . . 0.0 109.877 171.299 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.408 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 2.9 m -51.75 -37.22 50.23 Favored 'General case' 0 N--CA 1.428 -1.533 0 C-N-CA 125.508 1.523 . . . . 0.0 111.627 -176.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 28.8 m-20 -65.23 -50.8 64.46 Favored 'General case' 0 C--O 1.248 0.992 0 CA-C-N 115.795 -0.639 . . . . 0.0 109.799 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.536 ' HB3' HD11 ' A' ' 540' ' ' ILE . . . -65.98 -28.95 69.28 Favored 'General case' 0 CA--C 1.548 0.887 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.384 179.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.527 ' HA ' HG13 ' A' ' 530' ' ' VAL . 42.7 t -67.97 -35.36 71.65 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.688 0 C-N-CA 125.321 1.448 . . . . 0.0 110.997 175.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . 0.408 ' HG3' ' O ' ' A' ' 524' ' ' SER . 98.8 mt-30 -65.9 -30.5 71.1 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 174.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.549 ' HB3' ' HG2' ' A' ' 536' ' ' ARG . 31.5 m-85 -76.5 9.42 2.71 Favored 'General case' 0 N--CA 1.434 -1.271 0 N-CA-C 114.222 1.193 . . . . 0.0 114.222 175.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.617 ' HA ' ' CZ ' ' A' ' 536' ' ' ARG . 34.4 m -72.7 12.49 0.2 Allowed 'Isoleucine or valine' 0 N--CA 1.512 2.637 0 N-CA-C 116.652 2.093 . . . . 0.0 116.652 -176.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -108.46 -43.66 4.27 Favored 'General case' 0 C--N 1.276 -2.597 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 170.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 6.5 m -75.51 -144.07 0.02 OUTLIER 'General case' 0 C--N 1.289 -2.05 0 C-N-CA 127.73 2.412 . . . . 0.0 112.512 -178.606 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . 0.461 ' O ' ' N ' ' A' ' 535' ' ' LEU . 16.8 m120 -26.64 30.94 0.0 OUTLIER 'General case' 0 CA--C 1.469 -2.14 1 C-N-CA 138.99 6.916 . . . . 0.0 118.402 179.017 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . 0.534 ' HA ' ' NE ' ' A' ' 536' ' ' ARG . 9.0 pt-20 -30.07 -5.91 0.0 OUTLIER 'General case' 0 N--CA 1.514 2.752 0 C-N-CA 130.769 3.628 . . . . 0.0 116.904 -175.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.57 HD13 ' H ' ' A' ' 535' ' ' LEU . 0.0 OUTLIER -68.55 -12.18 60.94 Favored 'General case' 0 CA--C 1.57 1.745 0 N-CA-C 107.341 -1.355 . . . . 0.0 107.341 163.86 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.627 ' HD2' ' N ' ' A' ' 537' ' ' GLU . 3.8 ppt_? -66.8 -28.76 68.64 Favored 'General case' 0 C--O 1.215 -0.714 0 C-N-CA 126.65 1.98 . . . . 0.0 109.9 169.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . 0.627 ' N ' ' HD2' ' A' ' 536' ' ' ARG . 43.3 tt0 -77.05 -41.0 44.2 Favored 'General case' 0 CA--C 1.479 -1.77 0 N-CA-C 106.505 -1.665 . . . . 0.0 106.505 179.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' A' ' 541' ' ' SER . 18.5 m -56.3 -47.73 78.09 Favored 'General case' 0 N--CA 1.433 -1.28 0 CA-C-N 114.997 -1.001 . . . . 0.0 109.254 173.194 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 55.7 tp -57.59 -45.65 85.02 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 122.825 0.45 . . . . 0.0 111.526 176.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . 0.536 HD11 ' HB3' ' A' ' 526' ' ' ALA . 24.8 mm -61.25 -40.45 86.04 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.587 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 176.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . 0.431 ' HB3' ' O ' ' A' ' 538' ' ' THR . 35.9 t -57.24 -41.59 79.85 Favored 'General case' 0 C--N 1.313 -1.008 0 C-N-CA 123.543 0.737 . . . . 0.0 110.033 174.461 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.405 ' O ' ' HE2' ' A' ' 478' ' ' LYS . 3.8 mm? -63.09 -37.72 88.32 Favored 'General case' 0 C--O 1.21 -0.982 0 C-N-CA 120.975 -0.29 . . . . 0.0 111.164 174.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -68.7 -32.49 72.34 Favored 'General case' 0 C--O 1.246 0.902 0 CA-C-O 121.542 0.687 . . . . 0.0 110.441 178.278 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.5 tp60 -67.54 -34.95 78.13 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 115.182 -0.917 . . . . 0.0 109.122 176.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 -70.61 136.41 49.15 Favored 'General case' 0 N--CA 1.429 -1.508 0 CA-C-N 115.478 -0.783 . . . . 0.0 110.68 172.117 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -102.75 141.72 35.08 Favored 'General case' 0 C--N 1.286 -2.18 0 N-CA-C 114.248 1.203 . . . . 0.0 114.248 -169.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 87.1 mt -82.55 4.4 24.7 Favored 'General case' 0 C--N 1.315 -0.93 0 CA-C-N 114.068 -1.424 . . . . 0.0 109.193 171.666 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 37.1 t30 -73.08 -58.07 3.58 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 114.955 -1.02 . . . . 0.0 108.71 174.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -74.65 -6.06 46.58 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-N 115.661 -0.699 . . . . 0.0 112.226 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.436 ' HB3' HD22 ' A' ' 554' ' ' ASN . 41.4 mt-10 -109.22 139.5 21.09 Favored Pre-proline 0 C--N 1.306 -1.287 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.611 177.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . 0.46 ' HD2' ' ND2' ' A' ' 554' ' ' ASN . 16.3 Cg_exo -71.3 152.36 61.14 Favored 'Trans proline' 0 C--O 1.242 0.718 0 N-CA-C 107.166 -1.898 . . . . 0.0 107.166 168.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 41.5 p90 -76.32 -2.49 31.9 Favored 'General case' 0 CA--C 1.503 -0.833 0 C-N-CA 118.669 -1.212 . . . . 0.0 112.794 -176.215 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . 0.69 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 44.2 mp0 -74.96 -13.48 60.52 Favored 'General case' 0 C--N 1.278 -2.505 0 CA-C-N 115.064 -0.971 . . . . 0.0 110.032 173.924 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . 0.46 ' ND2' ' HD2' ' A' ' 551' ' ' PRO . 92.7 m-20 -69.31 -21.56 63.85 Favored 'General case' 0 CA--C 1.496 -1.115 0 CA-C-N 115.84 -0.618 . . . . 0.0 109.458 172.668 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -78.98 -92.74 0.04 OUTLIER 'General case' 0 N--CA 1.431 -1.424 0 CA-C-N 115.826 -0.625 . . . . 0.0 109.552 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 28.5 pt -58.89 -45.5 91.75 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -174.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . 0.69 ' HB3' ' O ' ' A' ' 553' ' ' GLU . 3.4 t70 -60.27 -60.75 3.32 Favored 'General case' 0 N--CA 1.485 1.284 0 CA-C-N 117.783 0.265 . . . . 0.0 110.509 -178.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -62.02 -41.77 98.45 Favored 'General case' 0 C--O 1.208 -1.121 0 CA-C-N 115.944 -0.571 . . . . 0.0 111.976 -178.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -54.69 -52.77 61.36 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 124.251 1.02 . . . . 0.0 111.026 178.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 71.7 t -65.07 -46.67 90.62 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.858 0 CA-C-N 115.793 -0.64 . . . . 0.0 109.518 179.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 76.4 m-20 -55.33 -46.42 76.36 Favored 'General case' 0 C--O 1.204 -1.296 0 C-N-CA 123.494 0.717 . . . . 0.0 112.503 179.329 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . 0.543 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 53.1 t -66.62 -40.42 86.2 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.123 0 N-CA-C 112.948 0.721 . . . . 0.0 112.948 -179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.496 HG23 HE21 ' A' ' 469' ' ' GLN . 54.1 mt -83.37 -32.78 9.44 Favored 'Isoleucine or valine' 0 C--N 1.283 -2.298 0 C-N-CA 119.587 -0.845 . . . . 0.0 110.75 -174.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -89.88 -8.24 52.35 Favored 'General case' 0 C--N 1.3 -1.544 0 CA-C-N 115.553 -0.749 . . . . 0.0 109.941 -176.563 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.543 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 12.4 pt-20 -76.72 -20.06 56.98 Favored 'General case' 0 CA--C 1.515 -0.379 0 N-CA-C 107.117 -1.438 . . . . 0.0 107.117 177.442 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -77.98 53.52 1.19 Allowed 'General case' 0 CA--C 1.562 1.416 0 CA-C-N 113.988 -1.46 . . . . 0.0 109.062 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -134.88 -127.55 2.72 Favored Glycine 0 N--CA 1.404 -3.434 0 N-CA-C 108.18 -1.968 . . . . 0.0 108.18 175.403 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 26.0 mp0 -111.16 13.72 21.82 Favored 'General case' 0 C--N 1.293 -1.887 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -71.63 116.24 11.75 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 113.887 -1.506 . . . . 0.0 111.581 -177.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . 0.645 ' HB ' ' OE2' ' A' ' 572' ' ' GLU . 1.3 m -97.41 -179.21 4.41 Favored 'General case' 0 N--CA 1.422 -1.83 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 178.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 9.5 pt -43.57 -44.35 1.68 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 N-CA-C 114.854 1.427 . . . . 0.0 114.854 -178.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . 0.697 ' OE1' ' HD2' ' A' ' 604' ' ' ARG . 0.0 OUTLIER -83.6 -28.35 28.56 Favored 'General case' 0 C--O 1.172 -2.979 0 C-N-CA 119.755 -0.778 . . . . 0.0 112.926 -179.142 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . 0.411 ' HA ' ' ND2' ' A' ' 601' ' ' ASN . 17.4 m -65.99 -22.33 66.46 Favored 'General case' 0 C--N 1.287 -2.119 0 CA-C-O 122.482 1.134 . . . . 0.0 109.558 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 570' ' ' THR . 56.4 mt -60.38 -30.93 69.89 Favored 'General case' 0 N--CA 1.421 -1.881 0 CA-C-N 113.846 -1.524 . . . . 0.0 108.422 173.272 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . 0.671 ' HB3' HG22 ' A' ' 598' ' ' VAL . 9.4 m120 -60.13 -47.01 87.7 Favored 'General case' 0 CA--C 1.5 -0.944 0 C-N-CA 123.743 0.817 . . . . 0.0 109.319 177.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . 0.464 ' HB2' ' OD1' ' A' ' 601' ' ' ASN . 16.8 t60 -56.14 -53.77 53.13 Favored 'General case' 0 CA--C 1.495 -1.14 0 O-C-N 124.118 0.886 . . . . 0.0 110.071 -178.498 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 19.6 pttp -69.48 -35.16 75.32 Favored 'General case' 0 C--N 1.319 -0.723 0 C-N-CA 119.572 -0.851 . . . . 0.0 113.015 -175.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 2.5 tt -61.17 -52.15 66.05 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 108.46 -0.941 . . . . 0.0 108.46 179.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.504 ' HB2' HG21 ' A' ' 598' ' ' VAL . 26.2 tpt85 -61.36 -38.19 86.07 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.404 178.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -68.65 -46.21 69.78 Favored 'General case' 0 C--N 1.317 -0.825 0 CA-C-N 116.274 -0.421 . . . . 0.0 111.024 -178.227 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -59.97 -45.15 93.6 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-O 121.291 0.567 . . . . 0.0 111.932 177.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.447 HG21 ' HE2' ' A' ' 591' ' ' LYS . 21.0 p -68.67 -25.91 65.04 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 123.536 0.734 . . . . 0.0 112.715 -179.276 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.402 ' HA ' ' OE1' ' A' ' 588' ' ' GLU . 73.6 ttt180 -53.67 1.86 0.01 OUTLIER 'General case' 0 CA--C 1.585 2.323 0 C-N-CA 126.713 2.005 . . . . 0.0 114.326 -178.649 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 7.0 tp -80.05 -10.8 12.67 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.578 0 CA-C-O 122.053 0.93 . . . . 0.0 110.864 -179.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 128.39 50.29 0.14 Allowed Glycine 0 C--N 1.298 -1.554 0 CA-C-O 122.14 0.856 . . . . 0.0 111.597 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . 0.562 ' C ' ' H ' ' A' ' 588' ' ' GLU . 38.9 t70 -95.27 169.24 10.22 Favored 'General case' 0 C--N 1.293 -1.86 0 C-N-CA 126.321 1.849 . . . . 0.0 109.658 179.196 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 29.4 m -46.62 23.22 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.586 2.338 0 C-N-CA 128.46 2.704 . . . . 0.0 114.914 170.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.562 ' H ' ' C ' ' A' ' 586' ' ' ASP . 37.3 mt-10 -43.11 -2.63 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 130.863 3.665 . . . . 0.0 116.207 -174.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 62.1 tp -72.65 -54.02 10.19 Favored 'General case' 0 C--O 1.266 1.938 0 N-CA-C 105.569 -2.011 . . . . 0.0 105.569 166.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 21.0 tt0 -53.37 -52.66 58.56 Favored 'General case' 0 CA--C 1.5 -0.957 0 CA-C-N 113.875 -1.511 . . . . 0.0 107.619 170.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.486 ' HB2' ' HA ' ' A' ' 588' ' ' GLU 0.39 62.1 mttp -73.78 -9.72 58.95 Favored 'General case' 0 N--CA 1.43 -1.445 0 N-CA-C 115.416 1.635 . . . . 0.0 115.416 -177.749 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 68.5 t80 -67.49 -41.16 84.98 Favored 'General case' 0 C--N 1.325 -0.478 0 N-CA-C 107.019 -1.475 . . . . 0.0 107.019 169.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 79.7 t80 -61.2 -43.03 99.53 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 115.447 -0.797 . . . . 0.0 109.154 173.218 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.447 ' O ' ' HB ' ' A' ' 597' ' ' ILE . 38.6 tp -59.24 -36.96 76.41 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 175.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.53 ' HA ' ' CG2' ' A' ' 598' ' ' VAL . 45.6 tt0 -67.64 -19.19 65.18 Favored 'General case' 0 C--O 1.206 -1.192 0 CA-C-N 115.029 -0.987 . . . . 0.0 111.922 178.528 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . 0.458 ' O ' ' HB3' ' A' ' 599' ' ' ALA . 86.5 mm-40 -68.8 -42.73 76.91 Favored 'General case' 0 C--N 1.318 -0.788 0 N-CA-C 107.799 -1.186 . . . . 0.0 107.799 168.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.447 ' HB ' ' O ' ' A' ' 594' ' ' LEU . 2.1 mp -59.51 -40.8 82.83 Favored 'Isoleucine or valine' 0 CA--C 1.577 2.016 0 CA-C-O 121.887 0.851 . . . . 0.0 109.32 171.439 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . 0.671 HG22 ' HB3' ' A' ' 575' ' ' ASN . 58.7 t -63.13 -29.39 47.12 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 CA-C-N 115.328 -0.851 . . . . 0.0 109.954 174.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.572 ' HA ' ' HE3' ' A' ' 602' ' ' LYS . . . -62.63 -39.57 94.24 Favored 'General case' 0 N--CA 1.434 -1.24 0 CA-C-N 116.067 -0.515 . . . . 0.0 109.986 178.008 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . 0.4 ' HB3' ' O ' ' A' ' 597' ' ' ILE . 5.1 ttpm? -60.35 -41.41 93.59 Favored 'General case' 0 C--O 1.256 1.437 0 CA-C-O 121.721 0.772 . . . . 0.0 109.351 174.9 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . 0.516 ' HB3' ' O ' ' A' ' 598' ' ' VAL . 1.8 t-20 -56.83 -54.23 48.8 Favored 'General case' 0 C--O 1.201 -1.472 0 CA-C-N 114.809 -1.087 . . . . 0.0 111.099 177.848 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.572 ' HE3' ' HA ' ' A' ' 599' ' ' ALA . 0.0 OUTLIER -73.24 -16.76 61.39 Favored 'General case' 0 C--N 1.273 -2.761 0 C-N-CA 120.064 -0.654 . . . . 0.0 112.247 -179.247 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -79.19 -8.62 59.15 Favored 'General case' 0 C--N 1.318 -0.761 0 N-CA-C 112.306 0.484 . . . . 0.0 112.306 171.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . 0.697 ' HD2' ' OE1' ' A' ' 572' ' ' GLU . 15.3 ptm180 -58.13 -22.74 52.26 Favored 'General case' 0 N--CA 1.503 2.221 0 CA-C-O 121.248 0.547 . . . . 0.0 111.391 178.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 20.5 ptm . . . . . 0 N--CA 1.425 -1.693 0 CA-C-O 118.799 -0.619 . . . . 0.0 110.072 -179.57 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 86.3 m-85 . . . . . 0 N--CA 1.449 -0.524 0 N-CA-C 110.008 -0.367 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 4.9 p-10 -96.93 138.73 34.02 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-O 120.999 0.428 . . . . 0.0 110.907 177.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 48.9 t-20 -136.72 111.05 8.45 Favored 'General case' 0 N--CA 1.402 -2.853 0 N-CA-C 101.44 -3.541 . . . . 0.0 101.44 179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.5 pp -49.23 161.3 0.18 Allowed 'General case' 0 C--N 1.267 -3.009 0 N-CA-C 116.137 1.903 . . . . 0.0 116.137 -173.408 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . 0.441 ' O ' ' HG2' ' A' ' 470' ' ' GLU . 28.8 m -89.14 137.13 32.6 Favored 'General case' 0 N--CA 1.42 -1.959 0 CA-C-N 114.347 -1.297 . . . . 0.0 110.711 -178.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . 0.478 HH21 ' CD ' ' A' ' 565' ' ' GLU . 20.1 ptt180 -60.09 -23.06 63.5 Favored 'General case' 0 C--O 1.26 1.643 0 CA-C-O 122.103 0.954 . . . . 0.0 111.001 176.51 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.456 ' OE1' ' HD2' ' A' ' 566' ' ' LYS . 0.0 OUTLIER -57.03 -38.17 72.78 Favored 'General case' 0 N--CA 1.434 -1.234 0 CA-C-N 114.353 -1.294 . . . . 0.0 110.837 177.361 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.635 ' O ' ' HG2' ' A' ' 474' ' ' ARG . 9.1 pt-20 -71.22 -21.9 62.07 Favored 'General case' 0 CA--C 1.51 -0.573 0 C-N-CA 119.281 -0.968 . . . . 0.0 111.699 -174.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 2.4 tmtp? -73.1 -39.99 65.35 Favored 'General case' 0 N--CA 1.441 -0.925 0 N-CA-C 106.738 -1.579 . . . . 0.0 106.738 176.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -60.75 -40.45 92.5 Favored 'General case' 0 N--CA 1.465 0.29 0 CA-C-N 115.938 -0.574 . . . . 0.0 110.091 175.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . 0.429 ' HG2' ' HA ' ' A' ' 470' ' ' GLU . 49.0 mm-40 -61.16 -35.71 77.86 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 116.255 -0.43 . . . . 0.0 110.79 176.529 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.635 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 21.0 mmt85 -58.63 -42.26 87.87 Favored 'General case' 0 N--CA 1.485 1.306 0 N-CA-C 109.142 -0.688 . . . . 0.0 109.142 178.578 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -71.46 -47.42 55.82 Favored 'General case' 0 C--O 1.22 -0.476 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.581 179.775 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -58.43 -34.15 70.48 Favored 'General case' 0 N--CA 1.474 0.726 0 CA-C-O 122.231 1.015 . . . . 0.0 110.794 -178.017 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.501 HD21 HG11 ' A' ' 507' ' ' VAL . 23.7 tp -61.49 -10.62 8.17 Favored 'General case' 0 CA--C 1.556 1.19 0 C-N-CA 125.987 1.715 . . . . 0.0 111.776 178.245 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.584 ' HD2' ' O ' ' A' ' 542' ' ' LEU . 9.0 mmpt? -82.57 -12.17 57.91 Favored 'General case' 0 CA--C 1.512 -0.493 0 N-CA-C 113.582 0.956 . . . . 0.0 113.582 -177.334 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 44.6 m170 -70.96 138.71 50.24 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 119.762 -0.775 . . . . 0.0 109.861 177.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 95.1 mt -65.62 137.99 57.71 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-O 121.478 0.656 . . . . 0.0 111.377 -175.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . 0.497 ' C ' ' HG3' ' A' ' 520' ' ' GLN . 0.9 OUTLIER -67.13 3.28 1.2 Allowed 'General case' 0 C--N 1.313 -1.0 0 CA-C-N 114.449 -1.251 . . . . 0.0 114.305 -174.235 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . 0.454 ' N ' ' HG3' ' A' ' 520' ' ' GLN . 18.8 tpt180 -66.8 -35.17 79.45 Favored 'General case' 0 CA--C 1.49 -1.345 0 N-CA-C 106.335 -1.728 . . . . 0.0 106.335 172.184 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 7.8 t70 -77.5 59.71 1.96 Allowed 'General case' 0 N--CA 1.424 -1.756 0 CA-C-N 114.682 -1.144 . . . . 0.0 109.363 172.347 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -44.13 -30.3 0.74 Allowed 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 125.138 1.375 . . . . 0.0 111.999 177.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -56.73 -58.57 7.51 Favored 'General case' 0 C--O 1.197 -1.663 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.699 175.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 98.8 m -53.19 -39.35 63.58 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.323 0.649 . . . . 0.0 112.002 -178.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . 0.423 ' CE1' ' HB3' ' A' ' 511' ' ' LEU . 41.6 t80 -54.87 -59.48 4.68 Favored 'General case' 0 CA--C 1.546 0.813 0 CA-C-O 121.106 0.479 . . . . 0.0 109.985 177.646 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 99.6 mt -81.64 -19.22 42.22 Favored 'General case' 0 C--N 1.308 -1.218 0 C-N-CA 120.131 -0.628 . . . . 0.0 112.477 -177.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 22.0 t-20 -70.97 -39.09 72.73 Favored 'General case' 0 CA--C 1.5 -0.97 0 C-N-CA 122.702 0.401 . . . . 0.0 110.23 177.672 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -77.62 -34.15 53.41 Favored 'General case' 0 N--CA 1.425 -1.679 0 N-CA-C 109.258 -0.645 . . . . 0.0 109.258 -178.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 35.6 m-85 -66.36 -24.02 66.43 Favored 'General case' 0 CA--C 1.54 0.587 0 C-N-CA 120.188 -0.605 . . . . 0.0 112.457 172.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -88.75 -27.26 21.29 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-O 121.029 0.443 . . . . 0.0 111.728 176.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 50.1 m -75.94 -31.02 58.89 Favored 'General case' 0 C--O 1.244 0.764 0 O-C-N 121.823 -0.548 . . . . 0.0 110.911 -178.014 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 34.3 t -106.89 155.54 7.55 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 N-CA-C 106.803 -1.554 . . . . 0.0 106.803 177.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 41.0 t0 -93.24 134.75 35.12 Favored 'General case' 0 N--CA 1.433 -1.287 0 C-N-CA 119.038 -1.065 . . . . 0.0 108.457 175.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.46 ' H ' ' HD2' ' A' ' 496' ' ' LYS 0.26 0.1 OUTLIER -89.59 -42.69 11.26 Favored 'General case' 0 C--N 1.285 -2.231 0 N-CA-C 117.55 2.426 . . . . 0.0 117.55 -164.919 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -60.21 -42.64 95.58 Favored 'General case' 0 N--CA 1.495 1.781 0 N-CA-C 115.456 1.651 . . . . 0.0 115.456 -165.751 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 55.8 m-80 -93.81 -22.89 18.39 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 119.135 -1.026 . . . . 0.0 112.099 179.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 43.8 t80 -81.79 -26.85 34.05 Favored 'General case' 0 C--N 1.312 -1.046 0 CA-C-O 121.136 0.493 . . . . 0.0 111.37 -174.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 89.5 m -71.81 101.39 2.6 Favored 'General case' 0 C--N 1.313 -1.012 0 CA-C-O 121.553 0.692 . . . . 0.0 111.476 -179.348 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 27.5 t-20 -78.4 167.86 20.68 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 171.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -58.59 -25.94 63.12 Favored 'General case' 0 CA--C 1.531 0.242 0 CA-C-N 118.357 0.526 . . . . 0.0 110.212 -179.703 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . 0.655 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 14.8 m80 -57.69 -60.16 4.11 Favored 'General case' 0 CA--C 1.518 -0.266 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.76 174.283 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 80.0 m-85 -61.0 -32.22 71.81 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.055 -0.975 . . . . 0.0 112.004 178.815 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 61.1 tttp -64.37 -46.73 82.11 Favored 'General case' 0 N--CA 1.438 -1.048 0 C-N-CA 123.332 0.653 . . . . 0.0 110.676 -179.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.655 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.266 13.7 p90 -66.06 -36.83 84.26 Favored 'General case' 0 N--CA 1.437 -1.083 0 C-N-CA 118.255 -1.378 . . . . 0.0 111.862 179.856 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . 0.501 HG11 HD21 ' A' ' 477' ' ' LEU . 12.9 t -66.5 -53.38 36.43 Favored 'Isoleucine or valine' 0 C--O 1.24 0.554 0 N-CA-C 109.581 -0.526 . . . . 0.0 109.581 179.4 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 62.7 t80 -48.24 -45.94 34.93 Favored 'General case' 0 CA--C 1.503 -0.851 0 O-C-N 124.283 0.989 . . . . 0.0 110.51 177.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -57.42 -53.56 56.78 Favored 'General case' 0 C--O 1.209 -1.069 0 O-C-N 123.848 0.717 . . . . 0.0 111.649 -179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 506' ' ' TYR . 21.8 t -55.85 -54.7 23.56 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.365 0 CA-C-O 121.543 0.687 . . . . 0.0 109.729 -178.431 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.423 ' HB3' ' CE1' ' A' ' 487' ' ' PHE . 7.4 mp -60.88 -53.96 50.9 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.759 -175.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 57.1 t60 -65.86 -38.03 87.76 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 123.829 0.852 . . . . 0.0 112.304 -177.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -67.52 -40.63 85.08 Favored 'General case' 0 N--CA 1.474 0.771 0 CA-C-N 117.469 0.122 . . . . 0.0 111.18 -176.564 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 32.6 m-85 -71.58 -49.05 44.14 Favored 'General case' 0 C--O 1.204 -1.342 0 N-CA-C 109.82 -0.437 . . . . 0.0 109.82 177.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -50.88 -39.75 54.77 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 124.291 1.036 . . . . 0.0 110.451 178.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -62.11 -29.71 70.52 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-N 115.982 -0.553 . . . . 0.0 112.186 -177.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 40.7 mt-10 -107.31 -40.43 5.39 Favored 'General case' 0 C--N 1.307 -1.257 0 C-N-CA 119.884 -0.726 . . . . 0.0 111.388 -179.682 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 65.6 t30 -128.21 -176.92 3.95 Favored 'General case' 0 C--N 1.288 -2.071 0 CA-C-N 115.318 -0.855 . . . . 0.0 110.809 -167.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 2.5 p30 -76.41 -154.84 0.05 Allowed 'General case' 0 C--N 1.293 -1.885 0 C-N-CA 128.002 2.521 . . . . 0.0 112.001 177.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . 0.497 ' HG3' ' C ' ' A' ' 481' ' ' MET . 6.1 tt0 -58.51 146.97 33.6 Favored 'General case' 0 C--N 1.318 -0.792 0 C-N-CA 125.068 1.347 . . . . 0.0 112.111 -166.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -90.87 146.33 24.01 Favored 'General case' 0 N--CA 1.383 -3.785 0 N-CA-C 105.942 -1.873 . . . . 0.0 105.942 179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 42.1 m-80 -112.98 157.62 21.27 Favored 'General case' 0 C--N 1.298 -1.669 0 C-N-CA 120.213 -0.595 . . . . 0.0 111.062 -176.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.6 pp -72.11 -10.81 14.36 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 121.676 0.751 . . . . 0.0 110.601 178.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 19.4 m -58.38 -38.35 77.12 Favored 'General case' 0 N--CA 1.436 -1.14 0 CA-C-N 114.912 -1.04 . . . . 0.0 109.203 170.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 20.3 m-20 -65.12 -36.11 83.25 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-N 116.086 -0.507 . . . . 0.0 110.032 179.351 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -61.57 -48.84 79.13 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.2 177.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.423 ' O ' HG22 ' A' ' 530' ' ' VAL . 10.6 p -68.36 -28.47 40.7 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 CA-C-O 121.324 0.583 . . . . 0.0 110.961 177.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -74.51 -12.14 60.4 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 121.559 -0.713 . . . . 0.0 110.633 173.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -78.4 -29.28 47.17 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 176.502 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.423 HG22 ' O ' ' A' ' 527' ' ' VAL 0.337 30.1 m -73.93 54.02 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 N-CA-C 116.405 2.002 . . . . 0.0 116.405 -173.592 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -107.07 -29.06 9.62 Favored 'General case' 0 C--N 1.301 -1.524 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 173.385 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 13.0 m -90.33 155.48 18.94 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 107.613 -1.254 . . . . 0.0 107.613 172.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -69.12 -73.76 0.14 Allowed 'General case' 0 C--O 1.203 -1.359 0 N-CA-C 116.483 2.031 . . . . 0.0 116.483 -172.825 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 27.5 tt0 -80.19 -64.34 1.21 Allowed 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 -164.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 84.5 mt -57.15 -42.49 81.11 Favored 'General case' 0 C--O 1.247 0.932 0 CA-C-O 121.702 0.763 . . . . 0.0 112.46 -168.208 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 -79.55 -29.31 41.32 Favored 'General case' 0 N--CA 1.398 -3.044 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.962 -175.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -70.03 -39.97 75.46 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 174.018 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.401 ' O ' HD13 ' A' ' 542' ' ' LEU . 40.3 m -54.28 -46.12 72.64 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 115.849 -0.614 . . . . 0.0 109.892 177.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . 0.422 HD22 ' HA ' ' A' ' 539' ' ' LEU . 0.4 OUTLIER -60.88 -43.67 98.15 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 120.569 -0.453 . . . . 0.0 110.631 178.836 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . 0.428 HD13 ' HA ' ' A' ' 540' ' ' ILE . 13.8 mm -62.86 -40.71 89.84 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.87 0 CA-C-O 120.836 0.35 . . . . 0.0 110.923 176.228 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . 0.526 ' HA ' HE21 ' A' ' 544' ' ' GLN . 49.1 m -54.1 -41.42 68.28 Favored 'General case' 0 C--N 1.308 -1.203 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.381 174.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.584 ' O ' ' HD2' ' A' ' 478' ' ' LYS . 10.3 mp -66.79 -49.79 64.72 Favored 'General case' 0 C--O 1.209 -1.074 0 CA-C-N 115.785 -0.643 . . . . 0.0 110.611 172.129 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -54.39 -46.72 73.16 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 125.423 1.489 . . . . 0.0 111.608 -173.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . 0.526 HE21 ' HA ' ' A' ' 541' ' ' SER . 29.0 pt20 -72.78 12.74 0.46 Allowed 'General case' 0 CA--C 1.552 1.026 0 N-CA-C 114.375 1.25 . . . . 0.0 114.375 -176.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 80.1 t80 -67.03 133.39 49.81 Favored 'General case' 0 C--N 1.323 -0.549 0 N-CA-C 108.56 -0.904 . . . . 0.0 108.56 172.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -93.31 92.2 7.58 Favored 'General case' 0 C--N 1.315 -0.92 0 C-N-CA 119.883 -0.727 . . . . 0.0 109.48 -177.627 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 3.5 pp -81.86 -22.78 36.75 Favored 'General case' 0 C--O 1.205 -1.24 0 CA-C-N 115.428 -0.806 . . . . 0.0 112.077 -177.856 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 9.7 t30 -75.61 -12.4 60.2 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.932 0.872 . . . . 0.0 110.292 -177.854 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -71.7 -36.0 70.42 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 114.454 -1.248 . . . . 0.0 112.26 177.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -125.16 143.59 44.74 Favored Pre-proline 0 C--N 1.313 -1.018 0 CA-C-O 119.308 -0.377 . . . . 0.0 110.132 -174.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_exo -36.79 129.17 0.49 Allowed 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 124.084 3.189 . . . . 0.0 113.246 174.132 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 45.2 p90 -79.93 -15.35 57.49 Favored 'General case' 0 CA--C 1.491 -1.299 0 CA-C-O 122.331 1.062 . . . . 0.0 110.502 -176.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -78.8 -12.79 60.04 Favored 'General case' 0 N--CA 1.401 -2.924 0 CA-C-N 114.234 -1.348 . . . . 0.0 111.137 175.765 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 53.7 t30 -74.09 -36.45 64.28 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 175.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -59.04 -60.13 4.36 Favored 'General case' 0 C--O 1.203 -1.381 0 CA-C-N 114.655 -1.157 . . . . 0.0 110.628 -177.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 31.2 pt -57.74 -34.4 47.72 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 O-C-N 123.34 0.4 . . . . 0.0 111.935 -179.798 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -62.77 -56.28 18.98 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 121.868 0.842 . . . . 0.0 109.234 178.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . 0.627 ' O ' HG23 ' A' ' 562' ' ' VAL . 27.0 t70 -59.45 -50.37 74.19 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-N 114.504 -1.225 . . . . 0.0 109.754 178.178 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . 0.527 ' O ' HD13 ' A' ' 563' ' ' ILE . 78.0 t80 -50.82 -53.51 31.49 Favored 'General case' 0 C--N 1.313 -0.979 0 C-N-CA 125.564 1.546 . . . . 0.0 111.973 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . 0.432 ' O ' ' HB3' ' A' ' 564' ' ' ASN . 14.4 p -59.84 -40.14 81.9 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.528 0 C-N-CA 119.87 -0.732 . . . . 0.0 110.51 -178.479 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 49.8 t30 -62.62 -47.65 82.84 Favored 'General case' 0 C--N 1.312 -1.035 0 C-N-CA 123.128 0.571 . . . . 0.0 111.287 178.14 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . 0.627 HG23 ' O ' ' A' ' 558' ' ' ASP . 38.2 t -69.81 -30.03 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 C-N-CA 123.87 0.868 . . . . 0.0 112.236 -178.497 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.527 HD13 ' O ' ' A' ' 559' ' ' TYR . 1.3 mp -86.84 -48.98 15.27 Favored 'Isoleucine or valine' 0 C--N 1.279 -2.489 0 CA-C-O 122.222 1.01 . . . . 0.0 109.346 -172.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . 0.432 ' HB3' ' O ' ' A' ' 560' ' ' VAL . 26.9 t-20 -78.26 4.35 13.0 Favored 'General case' 0 C--N 1.293 -1.876 0 CA-C-N 114.18 -1.373 . . . . 0.0 109.582 178.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.478 ' CD ' HH21 ' A' ' 468' ' ' ARG . 2.5 tm-20 -65.3 -28.07 69.06 Favored 'General case' 0 C--O 1.224 -0.261 0 N-CA-C 107.131 -1.433 . . . . 0.0 107.131 172.361 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . 0.456 ' HD2' ' OE1' ' A' ' 469' ' ' GLN . 68.4 mttm -79.48 16.03 1.14 Allowed 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 115.278 -0.874 . . . . 0.0 112.068 175.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -130.72 -64.26 0.1 OUTLIER Glycine 0 N--CA 1.42 -2.422 0 N-CA-C 106.417 -2.673 . . . . 0.0 106.417 171.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 50.99 105.67 0.01 OUTLIER 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 127.412 2.285 . . . . 0.0 115.212 173.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -94.96 -178.92 4.65 Favored 'General case' 0 C--N 1.286 -2.152 0 N-CA-C 105.707 -1.96 . . . . 0.0 105.707 172.714 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -67.03 162.04 23.04 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 113.819 1.044 . . . . 0.0 113.819 -178.171 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.407 ' N ' HD13 ' A' ' 571' ' ' ILE . 0.1 OUTLIER -46.4 -42.62 5.19 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.616 0 C-N-CA 125.595 1.558 . . . . 0.0 113.774 -179.456 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.97 -36.43 56.47 Favored 'General case' 0 N--CA 1.417 -2.085 0 C-N-CA 119.751 -0.78 . . . . 0.0 112.551 -177.59 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . 0.541 ' O ' ' HB3' ' A' ' 576' ' ' HIS . 24.7 t -69.83 -41.94 74.28 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.067 -0.515 . . . . 0.0 110.786 177.519 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.414 ' O ' ' HG ' ' A' ' 578' ' ' LEU 0.251 3.9 pp -67.39 -32.68 73.75 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 119.675 -0.81 . . . . 0.0 111.146 175.849 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . 0.589 ' O ' ' HG3' ' A' ' 579' ' ' ARG . 5.3 t30 -58.81 -49.18 78.66 Favored 'General case' 0 N--CA 1.471 0.62 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 172.223 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . 0.541 ' HB3' ' O ' ' A' ' 573' ' ' SER . 3.6 t60 -54.21 -47.85 71.69 Favored 'General case' 0 N--CA 1.468 0.425 0 C-N-CA 124.876 1.27 . . . . 0.0 109.241 176.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 38.7 ttmt -60.13 -52.9 63.36 Favored 'General case' 0 C--N 1.316 -0.852 0 C-N-CA 123.855 0.862 . . . . 0.0 111.217 179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 574' ' ' LEU . 96.8 mt -57.06 -57.41 12.68 Favored 'General case' 0 N--CA 1.468 0.455 0 CA-C-N 116.117 -0.492 . . . . 0.0 111.936 -179.381 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.589 ' HG3' ' O ' ' A' ' 575' ' ' ASN 0.28 0.0 OUTLIER -62.61 -25.9 68.34 Favored 'General case' 0 C--O 1.215 -0.722 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 -178.876 . . . . . . . . 4 4 . 1 . 002 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . 0.594 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 41.1 tt0 -71.21 -34.94 71.32 Favored 'General case' 0 C--N 1.318 -0.765 0 C-N-CA 120.29 -0.564 . . . . 0.0 110.31 177.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -64.89 -46.53 81.38 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-O 121.097 0.475 . . . . 0.0 111.258 177.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.614 ' HB ' ' O ' ' A' ' 588' ' ' GLU . 19.8 p -70.28 -28.09 64.93 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-O 122.046 0.926 . . . . 0.0 112.527 -177.196 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.594 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 32.0 ttt-85 -51.42 -2.9 0.02 OUTLIER 'General case' 0 CA--C 1.584 2.266 0 C-N-CA 128.39 2.676 . . . . 0.0 114.582 175.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 17.9 tt -76.17 -11.32 13.91 Favored 'Isoleucine or valine' 0 CA--C 1.572 1.804 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 -171.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 100.89 1.1 55.07 Favored Glycine 0 N--CA 1.487 2.094 0 C-N-CA 119.683 -1.246 . . . . 0.0 113.223 176.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -81.91 167.8 18.57 Favored 'General case' 0 C--N 1.283 -2.322 0 C-N-CA 125.349 1.459 . . . . 0.0 108.43 176.062 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.56 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 55.5 t -48.5 -19.39 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.569 1.686 0 CA-C-N 119.68 1.127 . . . . 0.0 110.086 171.0 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.614 ' O ' ' HB ' ' A' ' 582' ' ' THR . 5.9 mm-40 -55.6 -25.32 37.96 Favored 'General case' 0 C--O 1.182 -2.462 0 O-C-N 121.87 -0.519 . . . . 0.0 111.209 167.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . 0.61 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 50.8 tp -72.2 -33.35 67.56 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.707 0.765 . . . . 0.0 109.156 176.624 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . 0.56 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 42.5 tt0 -60.34 -41.7 94.15 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 108.207 -1.035 . . . . 0.0 108.207 171.157 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 594' ' ' LEU . 25.8 tttm -76.19 -21.44 56.47 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.295 -1.321 . . . . 0.0 111.144 178.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.632 ' HA ' ' OE1' ' A' ' 595' ' ' GLN . 46.7 t80 -59.13 -42.13 89.88 Favored 'General case' 0 CA--C 1.502 -0.868 0 C-N-CA 124.143 0.977 . . . . 0.0 108.681 171.461 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . 0.602 ' O ' HG12 ' A' ' 597' ' ' ILE . 42.3 t80 -59.67 -35.14 73.85 Favored 'General case' 0 C--O 1.212 -0.887 0 CA-C-N 114.898 -1.046 . . . . 0.0 109.181 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.461 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 6.9 tt -62.42 -42.77 99.69 Favored 'General case' 0 CA--C 1.54 0.58 0 C-N-CA 123.052 0.541 . . . . 0.0 110.59 176.601 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.632 ' OE1' ' HA ' ' A' ' 592' ' ' TYR . 9.2 mp0 -67.16 -32.41 73.5 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 120.631 -0.427 . . . . 0.0 110.7 175.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . 0.418 ' HB3' ' O ' ' A' ' 593' ' ' TYR . 53.0 tt0 -62.85 -41.46 99.36 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.013 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.602 HG12 ' O ' ' A' ' 593' ' ' TYR . 43.8 mm -56.04 -53.22 41.15 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.452 0 N-CA-C 108.363 -0.976 . . . . 0.0 108.363 173.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 97.9 t -60.94 -36.31 71.16 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.228 -178.382 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.455 ' HA ' ' HZ2' ' A' ' 602' ' ' LYS . . . -58.93 -47.95 83.22 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 122.491 0.316 . . . . 0.0 110.184 177.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -64.95 -44.61 88.85 Favored 'General case' 0 C--O 1.206 -1.232 0 O-C-N 123.517 0.511 . . . . 0.0 110.423 176.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -60.95 -44.36 97.38 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.007 0.743 . . . . 0.0 113.007 -177.226 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.542 ' HG3' ' HG3' ' A' ' 603' ' ' GLU . 25.1 pttm -69.74 -43.3 72.58 Favored 'General case' 0 C--N 1.311 -1.093 0 C-N-CA 119.876 -0.73 . . . . 0.0 109.573 -178.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . 0.542 ' HG3' ' HG3' ' A' ' 602' ' ' LYS . 31.1 mt-10 -81.97 2.75 29.36 Favored 'General case' 0 C--N 1.319 -0.737 0 C-N-CA 123.772 0.829 . . . . 0.0 112.769 -178.143 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 13.8 tpt180 -73.06 -29.65 63.13 Favored 'General case' 0 C--N 1.325 -0.475 0 C-N-CA 123.514 0.726 . . . . 0.0 109.742 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 64.7 mtt . . . . . 0 C--O 1.246 0.918 0 CA-C-N 115.382 -0.826 . . . . 0.0 110.576 -177.132 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 39.0 m-85 . . . . . 0 N--CA 1.435 -1.188 0 N-CA-C 111.496 0.184 . . . . 0.0 111.496 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 26.5 t70 -126.95 40.62 3.68 Favored 'General case' 0 C--N 1.304 -1.413 0 N-CA-C 105.475 -2.046 . . . . 0.0 105.475 169.041 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 30.1 p-10 -136.17 48.15 2.18 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 113.347 -1.751 . . . . 0.0 109.5 178.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 5.8 mp -67.36 80.84 0.15 Allowed 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 178.529 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . 0.484 ' OG ' ' HB2' ' A' ' 469' ' ' GLN . 21.9 t -111.27 124.16 51.67 Favored 'General case' 0 N--CA 1.405 -2.71 0 N-CA-C 115.426 1.639 . . . . 0.0 115.426 -169.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 1.1 tmt_? -67.3 -28.84 68.33 Favored 'General case' 0 CA--C 1.547 0.838 0 N-CA-C 106.811 -1.552 . . . . 0.0 106.811 168.912 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.484 ' HB2' ' OG ' ' A' ' 467' ' ' SER . 1.7 mp0 -68.66 -42.97 77.15 Favored 'General case' 0 C--O 1.22 -0.499 0 C-N-CA 124.445 1.098 . . . . 0.0 110.18 -178.41 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.562 ' OE2' ' HB2' ' A' ' 501' ' ' ASN . 0.7 OUTLIER -68.61 -34.8 76.4 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 178.266 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 3.6 tppp? -63.49 -36.09 82.6 Favored 'General case' 0 CA--C 1.545 0.767 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.178 172.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -62.65 -33.67 75.51 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.299 0.571 . . . . 0.0 109.91 176.834 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . 0.423 ' HA ' ' HB2' ' A' ' 476' ' ' PHE . 52.7 mt-10 -73.72 -28.69 61.84 Favored 'General case' 0 N--CA 1.446 -0.668 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.808 175.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 94.2 mtt180 -69.07 -32.92 72.72 Favored 'General case' 0 C--N 1.316 -0.89 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 173.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -69.4 -40.93 77.06 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 115.81 -0.632 . . . . 0.0 109.504 174.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . 0.423 ' HB2' ' HA ' ' A' ' 473' ' ' GLU . 0.1 OUTLIER -59.37 -27.78 66.27 Favored 'General case' 0 CA--C 1.548 0.874 0 CA-C-N 116.126 -0.488 . . . . 0.0 110.697 176.003 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.413 HD23 ' HA ' ' A' ' 477' ' ' LEU . 19.4 mt -69.97 -8.97 53.34 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 115.113 1.523 . . . . 0.0 115.113 178.22 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.489 ' HG3' ' N ' ' A' ' 479' ' ' HIS . 59.3 pttt -43.08 -51.13 5.96 Favored 'General case' 0 N--CA 1.475 0.808 0 O-C-N 124.386 1.054 . . . . 0.0 110.289 179.201 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.489 ' N ' ' HG3' ' A' ' 478' ' ' LYS . 3.9 p80 46.29 161.31 0.0 OUTLIER 'General case' 0 CA--C 1.55 0.965 0 C-N-CA 128.488 2.715 . . . . 0.0 116.218 178.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.425 ' HB2' ' HG2' ' A' ' 482' ' ' ARG . 65.2 mt -143.21 -154.66 0.54 Allowed 'General case' 0 C--N 1.281 -2.407 0 N-CA-C 106.353 -1.721 . . . . 0.0 106.353 170.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.34 -28.27 19.94 Favored 'General case' 0 C--N 1.304 -1.399 0 N-CA-C 109.482 -0.562 . . . . 0.0 109.482 176.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . 0.63 ' HG3' ' N ' ' A' ' 483' ' ' ASP . 23.2 ptt180 -64.41 -52.96 55.53 Favored 'General case' 0 N--CA 1.469 0.475 0 C-N-CA 124.991 1.317 . . . . 0.0 113.078 -177.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . 0.63 ' N ' ' HG3' ' A' ' 482' ' ' ARG 0.252 1.1 p30 -76.6 31.29 0.13 Allowed 'General case' 0 N--CA 1.419 -1.993 0 N-CA-C 117.172 2.286 . . . . 0.0 117.172 -164.979 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . 0.494 ' HD2' ' N ' ' A' ' 485' ' ' ASP . 0.1 OUTLIER -67.41 -28.43 67.91 Favored 'General case' 0 N--CA 1.44 -0.963 0 N-CA-C 107.667 -1.234 . . . . 0.0 107.667 170.695 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . 0.494 ' N ' ' HD2' ' A' ' 484' ' ' LYS . 4.7 p-10 -63.05 -44.77 94.92 Favored 'General case' 0 N--CA 1.451 -0.418 0 CA-C-N 114.584 -1.189 . . . . 0.0 109.304 174.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.45 ' HB ' ' HB2' ' A' ' 483' ' ' ASP . 43.5 m -65.17 -39.98 93.68 Favored 'General case' 0 N--CA 1.436 -1.169 0 C-N-CA 124.015 0.926 . . . . 0.0 110.17 -179.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 61.2 t80 -54.34 -54.46 40.07 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 116.097 -0.501 . . . . 0.0 110.208 174.423 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 36.2 tp -66.14 -34.22 77.55 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.734 -0.666 . . . . 0.0 110.671 -177.062 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 3.7 t-20 -67.68 -31.13 70.88 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 115.691 -0.686 . . . . 0.0 110.714 -178.219 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -82.61 -41.55 19.35 Favored 'General case' 0 N--CA 1.401 -2.907 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -179.119 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -57.99 -52.11 66.87 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 126.264 1.826 . . . . 0.0 110.831 -176.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.39 -20.08 59.15 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 115.28 -0.873 . . . . 0.0 112.313 -173.216 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 59.4 m -81.13 -47.23 13.77 Favored 'General case' 0 N--CA 1.436 -1.171 0 C-N-CA 119.917 -0.713 . . . . 0.0 111.982 -174.709 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 40.1 t -137.31 123.43 27.41 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.833 0 C-N-CA 120.464 -0.494 . . . . 0.0 109.813 -175.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 36.5 t70 -86.63 45.64 1.27 Allowed 'General case' 0 CA--C 1.55 0.965 0 CA-C-O 122.606 1.193 . . . . 0.0 110.146 -177.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.418 ' HG2' ' H ' ' A' ' 496' ' ' LYS . 50.9 pttt -89.16 14.83 9.92 Favored 'General case' 0 C--N 1.301 -1.522 0 CA-C-N 115.003 -0.999 . . . . 0.0 112.659 -177.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -66.27 -11.05 48.1 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 -170.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -84.66 -22.66 29.78 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 121.875 0.845 . . . . 0.0 109.14 175.371 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 82.1 t80 -79.99 -43.58 21.75 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 175.337 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 21.4 m -54.94 154.05 5.69 Favored 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 114.377 -1.283 . . . . 0.0 111.876 179.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.562 ' HB2' ' OE2' ' A' ' 470' ' ' GLU . 12.7 t-20 -66.42 150.02 49.54 Favored 'General case' 0 C--N 1.313 -1.006 0 C-N-CA 124.806 1.242 . . . . 0.0 111.496 -174.533 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -65.41 -21.73 66.7 Favored 'General case' 0 N--CA 1.469 0.478 0 C-N-CA 123.048 0.539 . . . . 0.0 110.313 -178.734 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . 0.645 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 49.3 m80 -61.43 -44.25 97.45 Favored 'General case' 0 CA--C 1.515 -0.392 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 174.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -65.78 -31.73 72.87 Favored 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 115.436 -0.802 . . . . 0.0 109.331 179.207 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 508' ' ' PHE . 46.8 tttm -61.81 -52.93 62.15 Favored 'General case' 0 CA--C 1.498 -1.037 0 C-N-CA 122.635 0.374 . . . . 0.0 110.594 -178.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.645 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.282 47.0 p90 -66.2 -25.19 66.81 Favored 'General case' 0 N--CA 1.438 -1.073 0 C-N-CA 117.516 -1.674 . . . . 0.0 111.863 -179.796 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 97.4 t -72.53 -40.38 63.06 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.9 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.367 174.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . 0.41 ' HB2' ' O ' ' A' ' 505' ' ' LYS . 8.2 m-85 -48.67 -50.47 32.97 Favored 'General case' 0 C--O 1.199 -1.6 0 C-N-CA 123.399 0.679 . . . . 0.0 109.526 171.139 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . 0.41 ' O ' ' HB2' ' A' ' 513' ' ' ASP . 38.6 mt-10 -57.28 -49.7 75.26 Favored 'General case' 0 CA--C 1.493 -1.223 0 N-CA-C 113.575 0.954 . . . . 0.0 113.575 -178.371 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 506' ' ' TYR . 9.9 t -60.43 -53.82 43.51 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.832 0 O-C-N 123.75 0.656 . . . . 0.0 109.262 179.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.433 ' HA ' ' HB2' ' A' ' 514' ' ' PHE . 95.8 mt -69.24 -32.29 71.41 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 113.431 0.9 . . . . 0.0 113.431 -174.515 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -67.07 -49.47 64.99 Favored 'General case' 0 C--N 1.315 -0.924 0 N-CA-C 108.626 -0.879 . . . . 0.0 108.626 175.237 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . 0.41 ' HB2' ' O ' ' A' ' 509' ' ' GLU . 0.4 OUTLIER -58.55 -38.39 77.71 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 115.644 -0.707 . . . . 0.0 110.368 173.843 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . 0.75 ' O ' ' HA ' ' A' ' 518' ' ' ASN . 13.8 m-85 -75.75 -3.87 37.29 Favored 'General case' 0 C--O 1.186 -2.279 0 C-N-CA 124.886 1.275 . . . . 0.0 114.31 174.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . 0.499 ' O ' ' HB3' ' A' ' 518' ' ' ASN . 2.6 m-85 -82.83 -35.62 26.22 Favored 'General case' 0 C--N 1.295 -1.793 0 O-C-N 121.154 -0.966 . . . . 0.0 110.356 165.778 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -68.61 -47.17 67.35 Favored 'General case' 0 C--N 1.318 -0.773 0 N-CA-C 107.32 -1.363 . . . . 0.0 107.32 170.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -99.02 61.45 1.25 Allowed 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 104.752 -2.314 . . . . 0.0 104.752 174.142 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . 0.75 ' HA ' ' O ' ' A' ' 514' ' ' PHE . 3.1 p-10 -59.61 -151.27 0.0 OUTLIER 'General case' 0 N--CA 1.505 2.312 0 C-N-CA 128.844 2.858 . . . . 0.0 116.125 -163.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . 0.358 3.3 p30 -31.54 -152.75 0.0 OUTLIER 'General case' 0 N--CA 1.528 3.441 0 N-CA-C 119.605 3.187 . . . . 0.0 119.605 -138.334 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -53.18 125.07 16.28 Favored 'General case' 0 N--CA 1.48 1.074 0 CA-C-O 124.01 1.862 . . . . 0.0 114.937 -145.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -94.83 176.58 6.21 Favored 'General case' 0 N--CA 1.416 -2.134 0 CA-C-N 109.648 -3.433 . . . . 0.0 110.483 -168.466 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 5.8 m-80 -108.03 136.51 47.6 Favored 'General case' 0 C--N 1.312 -1.048 0 N-CA-C 108.802 -0.814 . . . . 0.0 108.802 -174.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 36.8 pt -79.19 -14.48 13.47 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.823 0 N-CA-C 107.423 -1.325 . . . . 0.0 107.423 175.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.469 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 37.0 t -57.13 -30.97 64.87 Favored 'General case' 0 N--CA 1.43 -1.425 0 CA-C-N 114.382 -1.281 . . . . 0.0 109.642 172.071 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -63.03 -42.58 99.82 Favored 'General case' 0 C--N 1.358 0.956 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 175.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.432 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -62.17 -45.27 94.17 Favored 'General case' 0 C--N 1.325 -0.496 0 CA-C-N 115.53 -0.759 . . . . 0.0 109.295 177.227 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.44 ' O ' HG12 ' A' ' 530' ' ' VAL . 61.8 t -62.1 -26.07 39.12 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.702 0 CA-C-O 121.493 0.663 . . . . 0.0 111.186 175.463 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . 0.64 HE21 ' HA ' ' A' ' 528' ' ' GLN . 0.0 OUTLIER -71.16 -23.53 62.08 Favored 'General case' 0 C--N 1.328 -0.361 0 O-C-N 120.759 -1.213 . . . . 0.0 109.709 174.811 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.455 ' O ' ' HD3' ' A' ' 536' ' ' ARG . 16.2 m-85 -70.61 -31.71 68.78 Favored 'General case' 0 CA--C 1.503 -0.861 0 C-N-CA 120.699 -0.4 . . . . 0.0 111.901 174.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.44 HG12 ' O ' ' A' ' 527' ' ' VAL 0.326 14.6 p -74.97 54.73 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.559 1.321 0 N-CA-C 115.18 1.548 . . . . 0.0 115.18 -172.406 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 35.2 m-80 -107.02 -42.26 4.95 Favored 'General case' 0 C--N 1.302 -1.479 0 N-CA-C 107.443 -1.317 . . . . 0.0 107.443 173.502 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . 0.416 ' HB2' ' HD2' ' A' ' 536' ' ' ARG . 11.7 m -79.0 141.44 37.47 Favored 'General case' 0 N--CA 1.441 -0.898 0 N-CA-C 106.004 -1.85 . . . . 0.0 106.004 171.229 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -68.11 -84.0 0.03 OUTLIER 'General case' 0 C--O 1.198 -1.641 0 N-CA-C 113.331 0.864 . . . . 0.0 113.331 -173.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -52.63 -64.98 0.64 Allowed 'General case' 0 C--N 1.312 -1.057 0 N-CA-C 116.113 1.894 . . . . 0.0 116.113 -166.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 44.8 tp -57.14 -57.05 14.3 Favored 'General case' 0 C--O 1.267 2.004 0 CA-C-O 122.579 1.18 . . . . 0.0 111.299 -175.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.455 ' HD3' ' O ' ' A' ' 529' ' ' TYR . 62.8 mtt85 -76.19 -38.25 56.79 Favored 'General case' 0 N--CA 1.41 -2.462 0 CA-C-N 114.11 -1.405 . . . . 0.0 113.686 -171.44 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -61.27 -43.88 98.15 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-N 118.243 0.474 . . . . 0.0 110.042 175.3 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.469 ' O ' HD13 ' A' ' 542' ' ' LEU . 93.4 m -55.44 -43.39 75.37 Favored 'General case' 0 N--CA 1.437 -1.092 0 O-C-N 123.779 0.674 . . . . 0.0 111.045 178.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . 0.459 ' HB2' ' OH ' ' A' ' 506' ' ' TYR . 0.4 OUTLIER -57.9 -45.3 86.67 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 119.864 -0.734 . . . . 0.0 110.514 177.465 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . 0.595 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 1.7 mp -58.28 -43.96 87.16 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.311 0 CA-C-O 121.009 0.433 . . . . 0.0 110.368 178.788 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 19.8 m -54.5 -41.98 70.23 Favored 'General case' 0 CA--C 1.56 1.344 0 CA-C-N 115.883 -0.599 . . . . 0.0 111.211 174.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.469 HD13 ' O ' ' A' ' 538' ' ' THR . 9.1 mp -62.83 -42.12 99.6 Favored 'General case' 0 N--CA 1.481 1.079 0 C-N-CA 122.909 0.484 . . . . 0.0 110.472 175.573 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . 0.478 ' HA ' ' O ' ' A' ' 478' ' ' LYS . 40.5 tt0 -61.1 -37.23 82.01 Favored 'General case' 0 C--N 1.322 -0.616 0 C-N-CA 124.166 0.986 . . . . 0.0 111.78 -179.769 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . 0.595 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 72.8 mt-30 -68.83 -29.0 67.24 Favored 'General case' 0 CA--C 1.508 -0.637 0 CA-C-N 116.182 -0.463 . . . . 0.0 110.138 -178.806 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 27.1 t80 -76.96 84.4 3.49 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-O 121.767 0.794 . . . . 0.0 111.576 177.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.9 p30 -136.87 136.58 38.85 Favored 'General case' 0 C--N 1.296 -1.747 0 CA-C-N 115.904 -0.589 . . . . 0.0 110.568 -179.977 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 6.8 mp -90.35 23.54 2.9 Favored 'General case' 0 C--N 1.299 -1.596 0 C-N-CA 124.288 1.035 . . . . 0.0 111.209 177.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 7.5 t30 -62.08 -23.34 66.44 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -170.537 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -70.08 -15.49 62.99 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-O 120.891 0.377 . . . . 0.0 111.033 176.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -117.61 118.32 35.26 Favored Pre-proline 0 N--CA 1.43 -1.45 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 87.8 Cg_endo -84.63 38.74 0.7 Allowed 'Trans proline' 0 CA--C 1.541 0.825 0 C-N-CA 122.948 2.432 . . . . 0.0 110.968 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -128.5 48.61 2.29 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 108.08 -1.082 . . . . 0.0 108.08 -176.866 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -70.03 66.82 0.27 Allowed 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 114.475 1.287 . . . . 0.0 114.475 -175.586 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.07 -21.86 65.87 Favored 'General case' 0 C--O 1.214 -0.789 0 C-N-CA 125.657 1.583 . . . . 0.0 109.114 175.26 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -45.37 -38.44 5.87 Favored 'General case' 0 C--O 1.197 -1.659 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.89 174.021 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 43.9 mt -70.93 -42.24 77.12 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.455 0 C-N-CA 123.283 0.633 . . . . 0.0 109.545 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -60.49 -47.3 86.75 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-O 121.957 0.884 . . . . 0.0 109.389 176.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -57.64 -48.54 79.18 Favored 'General case' 0 C--O 1.211 -0.954 0 CA-C-N 113.938 -1.483 . . . . 0.0 110.296 175.673 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . 0.446 ' O ' HG13 ' A' ' 563' ' ' ILE . 27.9 t80 -56.89 -53.86 53.17 Favored 'General case' 0 C--N 1.302 -1.497 0 C-N-CA 125.47 1.508 . . . . 0.0 110.42 179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 40.4 t -58.4 -54.98 25.57 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.225 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.598 -178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.428 ' ND2' ' HB2' ' A' ' 576' ' ' HIS . 2.4 t30 -63.68 -42.78 97.98 Favored 'General case' 0 C--O 1.181 -2.502 0 CA-C-N 116.147 -0.478 . . . . 0.0 110.994 -178.009 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 2.6 p -65.75 -33.64 64.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.675 0 CA-C-N 118.158 0.435 . . . . 0.0 112.108 -173.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 559' ' ' TYR . 27.9 mt -84.82 -29.24 6.7 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.593 0 CA-C-O 121.538 0.685 . . . . 0.0 109.567 179.762 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -78.47 -36.19 45.61 Favored 'General case' 0 C--N 1.305 -1.359 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.668 -178.692 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.4 ' HG2' ' O ' ' A' ' 561' ' ' ASN . 12.3 pt-20 -75.09 -7.65 54.34 Favored 'General case' 0 C--O 1.24 0.553 0 CA-C-O 122.186 0.993 . . . . 0.0 110.401 -177.999 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -72.11 -26.13 62.01 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 114.791 -1.095 . . . . 0.0 108.988 177.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -93.72 -24.36 20.9 Favored Glycine 0 N--CA 1.436 -1.363 0 C-N-CA 119.77 -1.205 . . . . 0.0 112.571 -176.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . 0.569 ' HG2' ' HG3' ' A' ' 569' ' ' GLU . 4.6 pm0 -174.36 166.26 4.01 Favored 'General case' 0 N--CA 1.445 -0.675 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 -176.56 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . 0.569 ' HG3' ' HG2' ' A' ' 568' ' ' GLN . 42.0 mt-10 79.39 133.19 0.06 Allowed 'General case' 0 CA--C 1.546 0.816 0 C-N-CA 124.967 1.307 . . . . 0.0 113.042 176.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . 0.433 ' O ' ' HB2' ' A' ' 573' ' ' SER . 23.8 m -127.01 -37.47 2.09 Favored 'General case' 0 C--N 1.314 -0.949 0 CA-C-N 115.293 -0.867 . . . . 0.0 109.901 -176.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 4.0 mt -75.51 -24.02 17.0 Favored 'Isoleucine or valine' 0 CA--C 1.495 -1.171 0 N-CA-C 106.984 -1.487 . . . . 0.0 106.984 -179.756 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . 0.524 ' OE1' ' HG2' ' A' ' 602' ' ' LYS . 43.7 mm-40 -74.88 -22.88 58.39 Favored 'General case' 0 N--CA 1.409 -2.516 0 CA-C-N 113.579 -1.646 . . . . 0.0 111.014 -179.292 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . 0.433 ' HB2' ' O ' ' A' ' 570' ' ' THR . 66.6 m -63.26 -35.64 81.0 Favored 'General case' 0 N--CA 1.431 -1.421 0 N-CA-C 108.679 -0.86 . . . . 0.0 108.679 173.077 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.548 ' O ' ' HB3' ' A' ' 577' ' ' LYS . 50.1 mt -65.6 -41.34 92.89 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 115.305 -0.861 . . . . 0.0 109.165 174.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . 0.483 ' O ' ' HG3' ' A' ' 579' ' ' ARG . 28.5 t-20 -60.59 -40.58 92.31 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 116.118 -0.492 . . . . 0.0 110.24 176.192 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . 0.428 ' HB2' ' ND2' ' A' ' 561' ' ' ASN . 13.5 t-160 -56.43 -47.26 79.45 Favored 'General case' 0 N--CA 1.471 0.584 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 175.595 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . 0.548 ' HB3' ' O ' ' A' ' 574' ' ' LEU . 80.0 tttt -48.95 -47.23 43.99 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.461 0.705 . . . . 0.0 111.372 176.776 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 71.7 mt -58.1 -51.9 67.76 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 123.324 0.649 . . . . 0.0 111.322 178.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.796 ' O ' ' HB ' ' A' ' 582' ' ' THR . 8.5 mtm-85 -66.35 -34.96 79.14 Favored 'General case' 0 CA--C 1.547 0.859 0 CA-C-O 122.541 1.162 . . . . 0.0 110.412 -178.822 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . 0.437 ' O ' ' HG2' ' A' ' 583' ' ' ARG . 36.7 tt0 -61.33 -44.62 96.88 Favored 'General case' 0 C--N 1.3 -1.576 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.162 174.365 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -60.09 -33.72 72.47 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 121.747 0.784 . . . . 0.0 110.05 175.757 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.796 ' HB ' ' O ' ' A' ' 579' ' ' ARG . 16.0 m -61.89 -33.6 74.51 Favored 'General case' 0 C--N 1.302 -1.462 0 C-N-CA 125.93 1.692 . . . . 0.0 113.002 -179.113 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.437 ' HG2' ' O ' ' A' ' 580' ' ' GLU . 34.9 ptt180 -50.11 -13.64 0.12 Allowed 'General case' 0 N--CA 1.515 2.801 0 N-CA-C 115.128 1.529 . . . . 0.0 115.128 -178.52 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 20.2 tt -77.85 -6.35 9.01 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.714 0 N-CA-C 113.681 0.993 . . . . 0.0 113.681 -171.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 85.78 15.16 66.1 Favored Glycine 0 N--CA 1.472 1.097 0 C-N-CA 119.932 -1.128 . . . . 0.0 113.075 176.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -83.16 166.07 18.96 Favored 'General case' 0 C--N 1.294 -1.818 0 N-CA-C 106.97 -1.492 . . . . 0.0 106.97 175.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.53 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 35.6 m -54.63 -4.67 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.826 0 CA-C-N 119.649 1.113 . . . . 0.0 112.568 173.16 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.545 ' HA ' ' HB3' ' A' ' 591' ' ' LYS . 31.8 mt-10 -59.79 -14.97 17.05 Favored 'General case' 0 C--O 1.191 -1.995 0 O-C-N 121.837 -0.54 . . . . 0.0 110.293 164.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . 0.48 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 6.4 tt -71.81 -41.19 68.55 Favored 'General case' 0 CA--C 1.544 0.716 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 172.725 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . 0.53 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 6.9 tt0 -57.26 -36.51 71.06 Favored 'General case' 0 CA--C 1.549 0.925 0 CA-C-O 122.182 0.992 . . . . 0.0 108.606 170.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.564 ' O ' ' HG2' ' A' ' 595' ' ' GLN . 84.5 tttt -71.56 -30.66 66.11 Favored 'General case' 0 C--O 1.19 -2.035 0 CA-C-N 114.059 -1.428 . . . . 0.0 110.522 176.409 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.527 ' HB2' HG21 ' A' ' 582' ' ' THR . 84.1 t80 -57.32 -42.16 81.31 Favored 'General case' 0 N--CA 1.495 1.811 0 C-N-CA 124.148 0.979 . . . . 0.0 109.047 175.753 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . 0.43 ' O ' HG13 ' A' ' 597' ' ' ILE . 61.1 t80 -58.49 -44.94 89.57 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.8 177.305 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.492 ' O ' HG23 ' A' ' 598' ' ' VAL . 56.3 tp -62.94 -44.59 95.66 Favored 'General case' 0 C--O 1.212 -0.919 0 CA-C-N 115.58 -0.737 . . . . 0.0 110.471 175.369 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.564 ' HG2' ' O ' ' A' ' 591' ' ' LYS . 83.4 mm-40 -60.23 -42.65 95.68 Favored 'General case' 0 CA--C 1.509 -0.617 0 C-N-CA 123.547 0.739 . . . . 0.0 112.274 -177.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 6.0 mm100 -67.01 -37.01 83.41 Favored 'General case' 0 C--N 1.323 -0.584 0 C-N-CA 120.067 -0.653 . . . . 0.0 109.354 177.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.43 HG13 ' O ' ' A' ' 593' ' ' TYR . 67.0 mt -58.44 -45.15 89.97 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.585 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 172.945 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 594' ' ' LEU . 99.5 t -61.42 -40.05 84.94 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 C-N-CA 123.114 0.566 . . . . 0.0 110.353 178.038 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -61.18 -46.99 88.23 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.285 -0.416 . . . . 0.0 110.114 176.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt -63.57 -39.88 95.54 Favored 'General case' 0 C--N 1.321 -0.672 0 CA-C-N 116.088 -0.505 . . . . 0.0 109.803 176.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 10.1 t30 -60.81 -41.59 95.98 Favored 'General case' 0 C--N 1.318 -0.793 0 CA-C-N 115.713 -0.676 . . . . 0.0 111.967 -179.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.524 ' HG2' ' OE1' ' A' ' 572' ' ' GLU 0.268 0.0 OUTLIER -72.09 -28.41 63.28 Favored 'General case' 0 C--N 1.316 -0.853 0 C-N-CA 119.247 -0.981 . . . . 0.0 112.666 178.459 . . . . . . . . 4 4 . 1 . 003 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -74.01 -33.6 63.86 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 174.299 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 57.9 ttt180 -68.01 -42.45 80.69 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 123.892 0.877 . . . . 0.0 111.125 177.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 56.5 ttm . . . . . 0 C--N 1.308 -1.228 0 CA-C-N 115.933 -0.576 . . . . 0.0 110.152 -177.294 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 13.8 p90 . . . . . 0 N--CA 1.411 -2.394 0 N-CA-C 109.306 -0.627 . . . . 0.0 109.306 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 5.0 p-10 -93.67 135.3 35.09 Favored 'General case' 0 C--N 1.284 -2.24 0 N-CA-C 106.475 -1.676 . . . . 0.0 106.475 173.856 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 51.0 t30 -128.32 69.58 1.36 Allowed 'General case' 0 C--N 1.286 -2.181 0 CA-C-O 121.827 0.822 . . . . 0.0 110.059 -178.152 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 92.6 mt -66.93 116.82 8.21 Favored 'General case' 0 N--CA 1.428 -1.559 0 CA-C-N 113.93 -1.486 . . . . 0.0 108.492 174.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . 0.547 ' O ' ' HG2' ' A' ' 470' ' ' GLU . 47.3 t -95.05 141.09 29.1 Favored 'General case' 0 C--N 1.288 -2.07 0 CA-C-N 115.783 -0.644 . . . . 0.0 110.681 -174.756 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 12.8 ptp180 -65.67 -22.42 66.64 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 115.824 -0.625 . . . . 0.0 111.252 174.869 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -62.26 -36.93 83.57 Favored 'General case' 0 CA--C 1.519 -0.232 0 CA-C-N 116.658 -0.246 . . . . 0.0 111.46 -178.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.547 ' HG2' ' O ' ' A' ' 467' ' ' SER . 14.4 pt-20 -74.96 -23.92 58.37 Favored 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 120.233 -0.587 . . . . 0.0 109.723 -179.821 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 22.3 tptm -71.35 -36.49 71.52 Favored 'General case' 0 N--CA 1.449 -0.497 0 N-CA-C 108.652 -0.87 . . . . 0.0 108.652 177.028 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -63.04 -48.41 78.83 Favored 'General case' 0 C--N 1.325 -0.499 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 175.59 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 53.0 mm-40 -56.66 -41.7 77.71 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-N 116.132 -0.485 . . . . 0.0 111.179 174.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 9.9 mmt-85 -57.41 -40.89 79.27 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.163 0.506 . . . . 0.0 109.89 175.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . 0.647 ' O ' ' HG3' ' A' ' 478' ' ' LYS . . . -65.54 -40.22 92.64 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.267 -0.879 . . . . 0.0 110.939 -178.449 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -64.57 -48.04 76.48 Favored 'General case' 0 C--N 1.307 -1.258 0 CA-C-O 121.857 0.837 . . . . 0.0 110.81 173.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 31.8 tp -70.26 -3.17 15.84 Favored 'General case' 0 CA--C 1.571 1.761 0 C-N-CA 126.289 1.836 . . . . 0.0 114.456 -176.219 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.647 ' HG3' ' O ' ' A' ' 475' ' ' ALA . 35.4 mtmm -41.66 -63.47 0.71 Allowed 'General case' 0 N--CA 1.511 2.579 0 N-CA-C 114.825 1.417 . . . . 0.0 114.825 -172.214 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.535 ' CG ' ' HA ' ' A' ' 543' ' ' GLU . 0.4 OUTLIER -170.15 89.7 0.16 Allowed 'General case' 0 CA--C 1.505 -0.784 0 CA-C-O 121.918 0.866 . . . . 0.0 110.425 -179.447 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.549 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 96.1 mt -133.12 100.27 4.82 Favored 'General case' 0 C--N 1.278 -2.511 0 N-CA-C 106.744 -1.576 . . . . 0.0 106.744 178.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 4.0 mpp? -83.6 -72.68 0.45 Allowed 'General case' 0 C--N 1.303 -1.456 0 CA-C-N 114.44 -1.255 . . . . 0.0 112.036 -171.203 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.1 -9.02 50.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 113.785 1.032 . . . . 0.0 113.785 -179.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . 0.549 ' HB2' ' HB3' ' A' ' 480' ' ' LEU . 0.7 OUTLIER -70.79 57.67 0.2 Allowed 'General case' 0 C--N 1.315 -0.916 0 C-N-CA 125.152 1.381 . . . . 0.0 113.957 -177.524 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . 0.418 ' HE3' ' OH ' ' A' ' 515' ' ' TYR . 20.6 ptmt -54.95 -40.59 70.11 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 123.572 0.749 . . . . 0.0 111.321 178.148 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -63.39 -44.96 93.2 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 110.195 -0.298 . . . . 0.0 110.195 177.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.543 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 26.8 m -62.68 -39.06 92.76 Favored 'General case' 0 N--CA 1.45 -0.441 0 C-N-CA 122.208 0.203 . . . . 0.0 111.365 179.933 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . 0.441 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 61.6 t80 -56.02 -49.64 73.12 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 176.586 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 82.2 mt -71.9 -31.71 66.67 Favored 'General case' 0 C--N 1.313 -0.996 0 CA-C-N 115.706 -0.679 . . . . 0.0 110.941 -179.787 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.8 t-20 -68.58 -37.71 80.09 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.951 0.9 . . . . 0.0 111.571 -179.201 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -84.67 -23.66 29.32 Favored 'General case' 0 N--CA 1.413 -2.298 0 N-CA-C 109.4 -0.593 . . . . 0.0 109.4 177.21 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . 0.441 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.1 OUTLIER -65.12 -46.11 82.32 Favored 'General case' 0 C--O 1.218 -0.59 0 N-CA-C 107.975 -1.12 . . . . 0.0 107.975 176.213 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -78.38 -6.91 56.58 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-O 121.273 0.559 . . . . 0.0 111.247 178.311 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 36.8 t -78.8 -18.4 54.18 Favored 'General case' 0 C--N 1.314 -0.957 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 37.7 t -129.03 98.09 3.96 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.93 0 CA-C-N 115.852 -0.613 . . . . 0.0 109.865 -179.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 13.6 m-20 -99.25 -6.75 27.5 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 107.008 -1.479 . . . . 0.0 107.008 171.552 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 23.7 pttm -88.45 18.87 4.18 Favored 'General case' 0 C--N 1.312 -1.025 0 C-N-CA 127.212 2.205 . . . . 0.0 109.62 177.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -61.16 -0.62 0.36 Allowed 'General case' 0 N--CA 1.482 1.129 0 N-CA-C 114.98 1.474 . . . . 0.0 114.98 -172.868 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -75.75 -12.91 60.27 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 175.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 82.9 t80 -77.36 -12.84 60.0 Favored 'General case' 0 CA--C 1.552 1.043 0 CA-C-N 114.297 -1.319 . . . . 0.0 110.941 176.39 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 14.1 p -54.98 133.49 48.46 Favored 'General case' 0 CA--C 1.485 -1.546 0 N-CA-C 117.267 2.321 . . . . 0.0 117.267 -170.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 43.4 t-20 -73.73 137.9 44.29 Favored 'General case' 0 N--CA 1.413 -2.282 0 N-CA-C 104.551 -2.388 . . . . 0.0 104.551 170.663 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . 0.436 ' O ' ' HD1' ' A' ' 506' ' ' TYR . 46.4 tt0 -62.23 -18.58 61.54 Favored 'General case' 0 N--CA 1.482 1.139 0 CA-C-N 118.858 0.754 . . . . 0.0 110.985 -172.825 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -60.36 -41.98 94.81 Favored 'General case' 0 C--N 1.308 -1.206 0 CA-C-N 115.826 -0.624 . . . . 0.0 110.054 175.566 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 68.6 m-85 -63.56 -36.71 84.7 Favored 'General case' 0 C--O 1.209 -1.029 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.229 174.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.419 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 1.2 tmtp? -64.11 -36.07 82.83 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.074 -175.855 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.556 ' O ' HG23 ' A' ' 510' ' ' VAL . 45.6 m-85 -60.3 -54.09 49.87 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 115.523 -0.762 . . . . 0.0 109.964 172.022 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 21.7 t -59.82 -48.22 88.48 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-N 115.766 -0.652 . . . . 0.0 111.593 -177.529 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 42.4 m-85 -49.82 -49.9 47.22 Favored 'General case' 0 CA--C 1.51 -0.59 0 O-C-N 123.363 0.414 . . . . 0.0 111.636 176.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -57.92 -49.11 77.88 Favored 'General case' 0 N--CA 1.461 0.123 0 O-C-N 123.698 0.624 . . . . 0.0 110.413 -179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.556 HG23 ' O ' ' A' ' 506' ' ' TYR . 60.2 t -55.36 -58.85 3.3 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.561 0 O-C-N 123.786 0.679 . . . . 0.0 110.707 -178.488 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 9.5 mp -66.27 -44.5 83.41 Favored 'General case' 0 N--CA 1.436 -1.167 0 CA-C-N 115.913 -0.585 . . . . 0.0 112.04 -175.263 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 50.9 t-80 -62.17 -53.06 60.66 Favored 'General case' 0 C--N 1.312 -1.034 0 CA-C-N 116.244 -0.435 . . . . 0.0 111.977 -177.741 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -72.4 -29.32 63.63 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 -173.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 21.7 m-30 -76.68 -47.55 21.7 Favored 'General case' 0 C--N 1.304 -1.378 0 C-N-CA 119.38 -0.928 . . . . 0.0 109.659 177.712 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . 0.418 ' OH ' ' HE3' ' A' ' 484' ' ' LYS . 0.6 OUTLIER -52.3 -43.55 64.54 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.591 1.156 . . . . 0.0 109.466 176.246 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -68.65 -9.61 51.09 Favored 'General case' 0 CA--C 1.543 0.677 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -179.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -121.49 -48.23 2.19 Favored 'General case' 0 C--N 1.313 -1.014 0 O-C-N 121.917 -0.49 . . . . 0.0 111.694 -177.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 4.6 p-10 -121.16 -151.01 0.47 Allowed 'General case' 0 C--N 1.29 -1.984 0 C-N-CA 123.563 0.745 . . . . 0.0 109.386 -177.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.84 -160.62 0.16 Allowed 'General case' 0 C--N 1.312 -1.035 0 N-CA-C 108.223 -1.029 . . . . 0.0 108.223 -179.174 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 80.5 mm-40 -75.56 179.83 5.08 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.988 -0.445 . . . . 0.0 110.173 -178.251 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . 0.406 ' CD2' ' HB2' ' A' ' 525' ' ' ASP . 0.1 OUTLIER -88.55 138.35 31.5 Favored 'General case' 0 N--CA 1.384 -3.729 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 -176.8 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 32.2 m-80 -119.29 175.8 5.63 Favored 'General case' 0 C--N 1.286 -2.183 0 CA-C-N 116.946 -0.115 . . . . 0.0 110.796 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 35.0 pt -68.73 -18.56 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.466 0 CA-C-O 121.302 0.573 . . . . 0.0 110.992 -178.31 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.482 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 3.5 p -59.71 -41.33 90.58 Favored 'General case' 0 N--CA 1.435 -1.223 0 CA-C-O 121.787 0.803 . . . . 0.0 109.741 173.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . 0.406 ' HB2' ' CD2' ' A' ' 521' ' ' TYR . 40.9 m-20 -66.82 -36.91 83.46 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.27 -0.877 . . . . 0.0 110.001 -179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -59.8 -49.57 77.19 Favored 'General case' 0 C--O 1.221 -0.4 0 CA-C-N 115.387 -0.824 . . . . 0.0 111.273 178.036 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 9.5 p -68.15 -23.62 28.98 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.721 0 CA-C-O 120.903 0.382 . . . . 0.0 110.909 179.627 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . 0.482 ' HG3' ' O ' ' A' ' 524' ' ' SER . 26.6 mt-30 -67.28 -30.37 70.22 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 173.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.401 ' C ' ' H ' ' A' ' 531' ' ' ASN . 0.3 OUTLIER -83.17 16.59 2.35 Favored 'General case' 0 N--CA 1.438 -1.03 0 N-CA-C 113.843 1.053 . . . . 0.0 113.843 173.497 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.417 HG23 ' HG3' ' A' ' 536' ' ' ARG . 5.2 p -71.63 18.89 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.501 2.086 0 CA-C-O 121.928 0.871 . . . . 0.0 111.729 179.881 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . 0.401 ' H ' ' C ' ' A' ' 529' ' ' TYR . 10.4 p30 -107.86 -26.16 10.88 Favored 'General case' 0 C--N 1.302 -1.466 0 O-C-N 121.579 -0.701 . . . . 0.0 111.036 -178.611 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . 0.445 ' HB2' ' HB2' ' A' ' 535' ' ' LEU . 24.8 m -92.2 140.03 30.03 Favored 'General case' 0 N--CA 1.432 -1.37 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 179.467 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . 0.539 ' O ' ' HG2' ' A' ' 537' ' ' GLU . 19.3 m120 -57.84 -72.23 0.09 Allowed 'General case' 0 N--CA 1.474 0.743 0 N-CA-C 114.346 1.239 . . . . 0.0 114.346 -170.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -66.39 -32.45 73.85 Favored 'General case' 0 CA--C 1.512 -0.487 0 CA-C-O 120.67 0.271 . . . . 0.0 111.158 -174.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 532' ' ' SER . 3.7 mm? -61.88 -50.51 71.95 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.791 -0.641 . . . . 0.0 109.391 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.417 ' HG3' HG23 ' A' ' 530' ' ' VAL . 48.4 ttt180 -62.3 -61.53 2.39 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.869 178.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . 0.539 ' HG2' ' O ' ' A' ' 533' ' ' ASN . 12.7 pt-20 -61.22 -62.27 1.96 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 112.66 0.615 . . . . 0.0 112.66 -173.207 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.482 ' O ' HD13 ' A' ' 542' ' ' LEU . 75.7 m -65.27 -53.77 39.21 Favored 'General case' 0 N--CA 1.429 -1.509 0 N-CA-C 114.037 1.125 . . . . 0.0 114.037 -176.539 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . 0.435 ' HB3' ' O ' ' A' ' 535' ' ' LEU . 47.4 tp -61.38 -44.03 97.85 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 120.088 -0.645 . . . . 0.0 111.468 -174.697 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 57.2 mt -68.18 -34.83 68.68 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.712 0 C-N-CA 120.528 -0.469 . . . . 0.0 110.492 178.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 28.7 t -57.35 -49.22 76.84 Favored 'General case' 0 N--CA 1.476 0.87 0 CA-C-O 121.555 0.693 . . . . 0.0 109.477 174.999 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.482 HD13 ' O ' ' A' ' 538' ' ' THR . 6.5 mp -66.96 -24.41 66.05 Favored 'General case' 0 C--N 1.315 -0.925 0 CA-C-N 114.923 -1.035 . . . . 0.0 111.979 -179.824 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . 0.535 ' HA ' ' CG ' ' A' ' 479' ' ' HIS . 0.9 OUTLIER -81.42 -64.7 1.13 Allowed 'General case' 0 C--N 1.316 -0.849 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 179.04 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 -71.67 -59.59 2.68 Favored 'General case' 0 C--N 1.305 -1.348 0 CA-C-N 115.173 -0.921 . . . . 0.0 112.857 -171.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -73.04 90.28 1.5 Allowed 'General case' 0 N--CA 1.437 -1.081 0 N-CA-C 113.867 1.062 . . . . 0.0 113.867 -173.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.9 t30 -137.26 100.17 4.18 Favored 'General case' 0 C--N 1.293 -1.883 0 N-CA-C 106.839 -1.541 . . . . 0.0 106.839 173.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 5.5 tt -92.35 -82.54 0.32 Allowed 'General case' 0 CA--C 1.556 1.185 0 C-N-CA 118.589 -1.244 . . . . 0.0 111.518 -173.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 82.8 m-20 -104.66 -48.99 3.64 Favored 'General case' 0 CA--C 1.497 -1.079 0 CA-C-O 121.743 0.782 . . . . 0.0 112.137 177.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -68.23 36.25 0.03 OUTLIER 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 126.842 2.057 . . . . 0.0 113.824 -172.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.44 ' HA ' ' HD3' ' A' ' 551' ' ' PRO . 12.2 pt-20 -54.97 106.11 0.62 Allowed Pre-proline 0 C--O 1.244 0.798 0 C-N-CA 123.479 0.711 . . . . 0.0 112.174 -179.456 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . 0.44 ' HD3' ' HA ' ' A' ' 550' ' ' GLU . 43.6 Cg_endo -92.72 111.55 0.24 Allowed 'Trans proline' 0 N--CA 1.426 -2.443 0 C-N-CA 122.596 2.197 . . . . 0.0 114.389 -173.766 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 88.4 m-85 -131.26 -54.14 1.03 Allowed 'General case' 0 CA--C 1.494 -1.209 0 N-CA-C 106.955 -1.498 . . . . 0.0 106.955 172.266 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -75.02 -50.22 17.23 Favored 'General case' 0 C--N 1.287 -2.134 0 CA-C-N 113.853 -1.521 . . . . 0.0 108.585 177.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.6 m-20 -67.1 -24.16 65.91 Favored 'General case' 0 CA--C 1.507 -0.7 0 CA-C-N 114.27 -1.332 . . . . 0.0 109.052 178.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . 0.426 ' CD ' ' HB1' ' A' ' 475' ' ' ALA . 6.1 tp10 -68.07 -56.61 8.25 Favored 'General case' 0 N--CA 1.437 -1.092 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.58 -177.237 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 72.8 mt -54.71 -40.92 53.5 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.762 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 178.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -58.21 -51.67 68.79 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-N 116.328 -0.396 . . . . 0.0 111.431 178.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -66.16 -49.45 67.34 Favored 'General case' 0 CA--C 1.507 -0.702 0 CA-C-N 115.793 -0.64 . . . . 0.0 110.192 -179.072 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . 0.613 ' O ' HG12 ' A' ' 563' ' ' ILE . 87.5 t80 -51.49 -53.44 37.37 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 125.352 1.461 . . . . 0.0 110.233 178.644 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 75.7 t -61.41 -45.92 97.64 Favored 'Isoleucine or valine' 0 C--O 1.191 -1.985 0 N-CA-C 110.17 -0.307 . . . . 0.0 110.17 178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -58.46 -39.72 80.68 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.741 0.416 . . . . 0.0 111.324 -179.426 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 76.3 t -70.12 -34.87 61.05 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 C-N-CA 123.187 0.595 . . . . 0.0 112.246 179.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.613 HG12 ' O ' ' A' ' 559' ' ' TYR . 47.7 mm -86.37 -38.32 12.42 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 N-CA-C 107.803 -1.184 . . . . 0.0 107.803 -174.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . 0.464 ' HA ' ' HA3' ' A' ' 567' ' ' GLY . 53.7 t30 -76.82 0.14 21.83 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 113.956 -1.475 . . . . 0.0 109.646 178.624 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -64.54 -36.17 83.35 Favored 'General case' 0 N--CA 1.446 -0.632 0 N-CA-C 104.781 -2.303 . . . . 0.0 104.781 173.391 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . 0.433 ' O ' ' HG2' ' A' ' 566' ' ' LYS . 54.1 tttm -116.0 25.9 10.37 Favored 'General case' 0 CA--C 1.553 1.071 0 CA-C-N 113.525 -1.67 . . . . 0.0 108.27 -179.473 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . 0.464 ' HA3' ' HA ' ' A' ' 564' ' ' ASN . . . -99.39 73.13 0.5 Allowed Glycine 0 N--CA 1.424 -2.134 0 C-N-CA 120.001 -1.095 . . . . 0.0 114.479 -171.048 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 11.4 pt20 -95.13 110.35 22.31 Favored 'General case' 0 C--N 1.288 -2.089 0 C-N-CA 120.397 -0.521 . . . . 0.0 109.61 172.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 9.9 tp10 72.02 152.88 0.12 Allowed 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 125.185 1.394 . . . . 0.0 110.332 -173.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 31.7 m 71.29 -60.21 0.52 Allowed 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 124.947 1.299 . . . . 0.0 111.236 -177.168 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.452 ' O ' ' HB2' ' A' ' 574' ' ' LEU . 4.7 mm -75.15 -22.9 16.95 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.903 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 -177.386 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . 0.507 ' O ' ' HB3' ' A' ' 575' ' ' ASN . 56.4 mt-10 -71.22 -15.89 62.48 Favored 'General case' 0 N--CA 1.422 -1.861 0 CA-C-N 114.912 -1.04 . . . . 0.0 112.079 178.728 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 47.1 t -68.46 -36.78 79.47 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 106.292 -1.744 . . . . 0.0 106.292 171.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.452 ' HB2' ' O ' ' A' ' 571' ' ' ILE . 7.8 mp -65.36 -16.79 63.96 Favored 'General case' 0 C--O 1.206 -1.23 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.165 175.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . 0.507 ' HB3' ' O ' ' A' ' 572' ' ' GLU . 21.2 t-20 -58.36 -46.99 85.23 Favored 'General case' 0 N--CA 1.474 0.725 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 170.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . 0.524 2.8 p80 -68.31 -34.22 75.75 Favored 'General case' 0 C--N 1.33 -0.258 0 N-CA-C 114.06 1.133 . . . . 0.0 114.06 173.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . 0.552 ' O ' ' HB3' ' A' ' 580' ' ' GLU . 0.3 OUTLIER -65.21 -32.43 74.11 Favored 'General case' 0 CA--C 1.564 1.504 0 CA-C-O 121.14 0.495 . . . . 0.0 110.371 174.697 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 40.6 tp -57.02 -46.14 82.56 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.652 ' O ' ' HD3' ' A' ' 579' ' ' ARG . 0.0 OUTLIER -60.18 -36.77 78.34 Favored 'General case' 0 CA--C 1.562 1.413 0 CA-C-N 115.117 -0.947 . . . . 0.0 109.924 175.73 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . 0.6 ' O ' ' HG2' ' A' ' 583' ' ' ARG . 26.1 tt0 -60.06 -50.55 73.28 Favored 'General case' 0 C--N 1.309 -1.191 0 C-N-CA 123.362 0.665 . . . . 0.0 110.677 -179.436 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -60.07 -44.85 94.45 Favored 'General case' 0 C--N 1.31 -1.145 0 CA-C-O 121.618 0.723 . . . . 0.0 111.002 177.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.519 ' HB ' ' CB ' ' A' ' 588' ' ' GLU . 40.2 p -69.77 -25.2 63.69 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 116.3 1.963 . . . . 0.0 116.3 -175.516 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 580' ' ' GLU . 6.7 ptp180 -51.12 -2.91 0.02 OUTLIER 'General case' 0 N--CA 1.513 2.693 0 N-CA-C 116.39 1.996 . . . . 0.0 116.39 -176.216 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 31.2 pt -74.95 -3.4 4.71 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 N-CA-C 114.585 1.328 . . . . 0.0 114.585 -173.111 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 120.95 -0.83 11.85 Favored Glycine 0 N--CA 1.476 1.351 0 C-N-CA 118.6 -1.762 . . . . 0.0 115.082 172.089 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -74.8 165.63 24.93 Favored 'General case' 0 C--N 1.298 -1.645 0 C-N-CA 122.986 0.514 . . . . 0.0 110.334 178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.571 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 13.5 t -56.92 -5.15 0.32 Allowed 'Isoleucine or valine' 0 C--O 1.207 -1.156 0 C-N-CA 125.79 1.636 . . . . 0.0 110.166 177.6 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.519 ' CB ' ' HB ' ' A' ' 582' ' ' THR . 8.9 mm-40 -61.09 -15.04 28.46 Favored 'General case' 0 C--N 1.299 -1.595 0 C-N-CA 123.299 0.64 . . . . 0.0 109.596 169.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . 0.539 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 65.3 tp -70.53 -35.26 73.07 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.336 -0.986 . . . . 0.0 108.336 171.501 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . 0.571 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 6.6 tp-100 -61.48 -39.08 89.61 Favored 'General case' 0 C--N 1.311 -1.087 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 172.19 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.523 ' O ' ' HB3' ' A' ' 594' ' ' LEU . 98.6 mttt -72.16 -23.4 61.28 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.83 174.417 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.539 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 43.8 t80 -58.38 -40.01 81.17 Favored 'General case' 0 C--O 1.211 -0.927 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 173.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 83.9 t80 -52.31 -48.63 65.29 Favored 'General case' 0 CA--C 1.55 0.962 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 173.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.523 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 15.6 tp -59.49 -52.87 63.72 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.566 0.746 . . . . 0.0 110.249 176.153 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.423 ' NE2' ' HB2' ' A' ' 599' ' ' ALA . 22.7 tm0? -62.4 -38.24 88.9 Favored 'General case' 0 C--O 1.202 -1.418 0 CA-C-N 114.831 -1.077 . . . . 0.0 111.373 -174.452 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . 0.402 ' O ' ' HB2' ' A' ' 600' ' ' LYS . 23.6 tp60 -62.45 -42.69 99.65 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 109.434 -0.58 . . . . 0.0 109.434 178.379 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 87.8 mt -58.98 -50.67 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.515 0 O-C-N 123.613 0.57 . . . . 0.0 110.534 175.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 70.1 t -65.35 -41.68 91.85 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.448 0 CA-C-N 116.007 -0.542 . . . . 0.0 111.059 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.423 ' HB2' ' NE2' ' A' ' 595' ' ' GLN . . . -64.27 -34.13 77.42 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-O 121.001 0.429 . . . . 0.0 110.335 176.968 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . 0.402 ' HB2' ' O ' ' A' ' 596' ' ' GLN . 21.7 tptt -65.54 -46.87 77.89 Favored 'General case' 0 C--O 1.208 -1.127 0 N-CA-C 107.644 -1.243 . . . . 0.0 107.644 176.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . 0.491 ' HA ' ' HD2' ' A' ' 604' ' ' ARG . 78.8 m-20 -67.23 -28.27 67.92 Favored 'General case' 0 CA--C 1.506 -0.737 0 CA-C-N 115.519 -0.764 . . . . 0.0 112.598 177.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.552 ' HG3' ' HG3' ' A' ' 603' ' ' GLU . 0.4 OUTLIER -67.64 -65.72 0.65 Allowed 'General case' 0 C--N 1.284 -2.267 0 CA-C-N 115.297 -0.865 . . . . 0.0 109.025 175.317 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . 0.552 ' HG3' ' HG3' ' A' ' 602' ' ' LYS . 52.2 mt-10 -89.33 19.35 4.46 Favored 'General case' 0 C--N 1.289 -2.034 0 N-CA-C 114.362 1.245 . . . . 0.0 114.362 -173.79 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . 0.491 ' HD2' ' HA ' ' A' ' 601' ' ' ASN . 15.9 ptm180 -72.83 -7.99 53.41 Favored 'General case' 0 N--CA 1.485 1.322 0 CA-C-O 121.567 0.698 . . . . 0.0 109.654 172.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 60.3 ttp . . . . . 0 N--CA 1.423 -1.79 0 CA-C-N 114.769 -1.105 . . . . 0.0 108.023 179.165 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 12.7 p90 . . . . . 0 N--CA 1.446 -0.665 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -70.45 153.08 43.33 Favored 'General case' 0 C--N 1.312 -1.055 0 CA-C-O 120.579 0.228 . . . . 0.0 111.512 -177.526 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 87.3 m-20 -91.64 47.82 1.4 Allowed 'General case' 0 C--N 1.311 -1.108 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -178.296 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 96.1 mt -67.23 95.12 0.4 Allowed 'General case' 0 C--N 1.311 -1.073 0 CA-C-N 115.44 -0.8 . . . . 0.0 109.385 178.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 67.2 p -101.94 -177.84 3.53 Favored 'General case' 0 C--N 1.292 -1.925 0 CA-C-N 115.269 -0.878 . . . . 0.0 112.191 -174.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 37.3 ptt180 -69.36 -18.19 63.76 Favored 'General case' 0 C--N 1.31 -1.12 0 CA-C-N 114.786 -1.097 . . . . 0.0 112.235 173.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.434 ' HA ' HG12 ' A' ' 562' ' ' VAL . 98.6 mt-30 -57.54 -67.62 0.31 Allowed 'General case' 0 CA--C 1.499 -0.991 0 N-CA-C 114.819 1.414 . . . . 0.0 114.819 -168.613 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.494 ' HA ' ' CB ' ' A' ' 473' ' ' GLU 0.449 11.7 pt-20 -77.1 -9.06 58.49 Favored 'General case' 0 N--CA 1.421 -1.887 0 N-CA-C 114.432 1.271 . . . . 0.0 114.432 -177.957 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 21.8 tptm -67.07 -44.46 80.03 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 109.057 -0.72 . . . . 0.0 109.057 170.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . 0.467 ' HB3' HD11 ' A' ' 563' ' ' ILE . . . -67.86 -27.78 66.98 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-O 121.768 0.794 . . . . 0.0 109.184 176.256 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . 0.494 ' CB ' ' HA ' ' A' ' 470' ' ' GLU . 0.1 OUTLIER -70.18 -45.14 67.3 Favored 'General case' 0 C--N 1.301 -1.508 0 CA-C-N 114.67 -1.15 . . . . 0.0 108.541 177.801 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.472 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 67.7 mtt180 -57.06 -35.31 69.19 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.19 0.519 . . . . 0.0 110.89 172.364 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . 0.401 ' HA ' HD12 ' A' ' 542' ' ' LEU . . . -69.5 -39.35 77.67 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-N 116.037 -0.529 . . . . 0.0 110.591 175.885 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . 0.554 ' O ' ' HB2' ' A' ' 479' ' ' HIS . 4.2 t80 -64.49 -38.39 90.84 Favored 'General case' 0 C--O 1.221 -0.438 0 C-N-CA 123.69 0.796 . . . . 0.0 110.097 178.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 56.3 tp -63.47 -43.35 97.57 Favored 'General case' 0 N--CA 1.465 0.294 0 C-N-CA 124.44 1.096 . . . . 0.0 111.162 177.454 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 22.9 tptm -74.61 -53.37 9.49 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 -179.463 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.554 ' HB2' ' O ' ' A' ' 476' ' ' PHE . 1.7 t-80 40.05 -97.15 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 127.096 2.159 . . . . 0.0 113.326 177.292 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.457 ' H ' ' HB3' ' A' ' 479' ' ' HIS . 3.2 mm? -136.27 153.24 51.25 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 105.865 -1.902 . . . . 0.0 105.865 173.648 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . 0.567 ' HG3' ' O ' ' A' ' 521' ' ' TYR . 58.7 ttp -54.29 -34.98 62.09 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 122.987 0.515 . . . . 0.0 112.316 -177.414 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 19.7 ptt-85 -66.83 -17.49 64.91 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 113.804 1.038 . . . . 0.0 113.804 -177.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . 0.47 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 4.6 m-20 -70.55 41.28 0.06 Allowed 'General case' 0 C--N 1.314 -0.95 0 N-CA-C 116.505 2.039 . . . . 0.0 116.505 -169.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . 0.584 ' HD2' ' CD2' ' A' ' 515' ' ' TYR . 30.6 mmtp -60.88 -42.77 98.59 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-O 121.136 0.493 . . . . 0.0 110.983 174.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -60.93 -50.41 73.52 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 115.406 -0.815 . . . . 0.0 109.093 178.534 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.47 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 59.3 m -58.32 -43.05 88.03 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 123.952 0.901 . . . . 0.0 111.266 179.056 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . 0.489 ' CE1' ' HB3' ' A' ' 511' ' ' LEU . 82.5 t80 -46.19 -55.35 7.23 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 124.748 1.219 . . . . 0.0 109.893 175.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 60.0 mt -79.02 -27.36 43.23 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.138 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 94.6 m-20 -67.07 -41.31 86.64 Favored 'General case' 0 CA--C 1.495 -1.166 0 N-CA-C 111.777 0.288 . . . . 0.0 111.777 -177.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.82 -38.7 20.9 Favored 'General case' 0 N--CA 1.424 -1.764 0 C-N-CA 120.116 -0.634 . . . . 0.0 109.786 -177.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 28.9 t80 -55.14 -58.2 8.64 Favored 'General case' 0 CA--C 1.52 -0.201 0 N-CA-C 114.25 1.204 . . . . 0.0 114.25 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -77.82 -14.38 59.59 Favored 'General case' 0 C--N 1.308 -1.228 0 C-N-CA 120.372 -0.531 . . . . 0.0 112.221 -170.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 43.5 m -82.31 -60.99 2.02 Favored 'General case' 0 N--CA 1.425 -1.68 0 N-CA-C 113.513 0.931 . . . . 0.0 113.513 -173.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . 0.412 HG12 ' O ' ' A' ' 495' ' ' ASP . 87.6 t -139.14 134.97 41.71 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 120.353 -0.539 . . . . 0.0 112.125 -167.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . 0.412 ' O ' HG12 ' A' ' 494' ' ' VAL . 12.0 m-20 -85.87 158.95 19.82 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 106.105 -1.813 . . . . 0.0 106.105 170.85 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.469 ' H ' ' HE3' ' A' ' 496' ' ' LYS . 0.0 OUTLIER -89.23 -90.89 0.13 Allowed 'General case' 0 CA--C 1.5 -0.962 0 C-N-CA 116.459 -2.096 . . . . 0.0 112.152 -167.08 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 37.6 t70 -106.25 -85.22 0.5 Allowed 'General case' 0 N--CA 1.431 -1.375 0 C-N-CA 114.444 -2.903 . . . . 0.0 113.02 171.059 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -127.79 -50.67 1.36 Allowed 'General case' 0 N--CA 1.466 0.339 0 C-N-CA 125.524 1.53 . . . . 0.0 114.991 171.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . 0.357 10.8 p90 -70.57 -93.15 0.01 OUTLIER 'General case' 0 CA--C 1.547 0.831 1 N-CA-C 123.904 4.779 . . . . 0.0 123.904 -149.646 . . . . . . . . 3 2 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 11.4 m -93.45 89.7 6.42 Favored 'General case' 0 C--N 1.307 -1.274 0 N-CA-C 114.481 1.289 . . . . 0.0 114.481 -161.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 31.5 p30 -127.25 42.02 3.4 Favored 'General case' 0 N--CA 1.446 -0.669 0 C-N-CA 117.769 -1.573 . . . . 0.0 114.227 177.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . 0.428 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 1.1 tm0? -90.13 -35.06 15.63 Favored 'General case' 0 CA--C 1.502 -0.902 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 168.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . 0.741 ' HA ' ' CE2' ' A' ' 506' ' ' TYR . 87.3 m-70 -62.86 -40.64 98.11 Favored 'General case' 0 CA--C 1.5 -0.965 0 CA-C-N 114.39 -1.277 . . . . 0.0 110.111 -178.42 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . 0.457 ' O ' ' HD2' ' A' ' 508' ' ' PHE . 37.2 m-85 -63.85 -40.78 97.37 Favored 'General case' 0 C--O 1.205 -1.267 0 CA-C-N 114.882 -1.054 . . . . 0.0 110.169 175.366 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.428 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 54.2 tttp -58.77 -50.36 74.21 Favored 'General case' 0 N--CA 1.433 -1.278 0 C-N-CA 123.688 0.795 . . . . 0.0 109.7 -175.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.741 ' CE2' ' HA ' ' A' ' 503' ' ' HIS 0.279 9.8 p90 -65.02 -36.62 84.98 Favored 'General case' 0 CA--C 1.554 1.119 0 C-N-CA 118.261 -1.375 . . . . 0.0 113.265 178.997 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 58.0 t -68.85 -48.75 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.764 0 C-N-CA 120.311 -0.555 . . . . 0.0 109.802 179.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . 0.457 ' HD2' ' O ' ' A' ' 504' ' ' PHE . 32.3 m-85 -51.79 -39.39 58.57 Favored 'General case' 0 CA--C 1.499 -0.998 0 O-C-N 123.826 0.704 . . . . 0.0 112.637 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -58.39 -61.17 2.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 O-C-N 123.747 0.654 . . . . 0.0 109.512 177.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 506' ' ' TYR . 32.0 t -58.29 -48.94 83.51 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.389 -176.778 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.489 ' HB3' ' CE1' ' A' ' 487' ' ' PHE . 2.9 tt -68.61 -40.83 80.23 Favored 'General case' 0 N--CA 1.43 -1.428 0 CA-C-N 115.902 -0.59 . . . . 0.0 110.802 -172.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -70.09 -35.11 73.94 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 177.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -61.89 -49.16 77.33 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.172 0.589 . . . . 0.0 110.427 178.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -63.45 -44.13 95.38 Favored 'General case' 0 C--O 1.195 -1.815 0 CA-C-N 116.102 -0.499 . . . . 0.0 110.952 175.762 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . 0.584 ' CD2' ' HD2' ' A' ' 484' ' ' LYS . 0.7 OUTLIER -52.98 -42.32 65.43 Favored 'General case' 0 CA--C 1.56 1.361 0 C-N-CA 124.142 0.977 . . . . 0.0 109.773 179.641 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.84 -21.34 63.38 Favored 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 113.396 0.887 . . . . 0.0 113.396 -178.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -116.03 -53.85 2.53 Favored 'General case' 0 N--CA 1.479 0.992 0 CA-C-O 121.87 0.843 . . . . 0.0 112.198 -178.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . 0.566 ' CG ' ' H ' ' A' ' 519' ' ' ASP . 22.8 t-20 -101.88 -152.36 0.44 Allowed 'General case' 0 C--N 1.281 -2.38 0 CA-C-N 114.161 -1.381 . . . . 0.0 110.248 -169.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . 0.566 ' H ' ' CG ' ' A' ' 518' ' ' ASN . 29.1 t70 -106.17 -158.15 0.64 Allowed 'General case' 0 C--N 1.272 -2.78 0 C-N-CA 128.505 2.722 . . . . 0.0 105.664 -170.619 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . 0.568 ' HA ' ' HE3' ' A' ' 484' ' ' LYS 0.412 3.5 pm0 -62.95 155.08 28.38 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 120.501 1.501 . . . . 0.0 112.71 178.25 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . 0.567 ' O ' ' HG3' ' A' ' 481' ' ' MET . 0.3 OUTLIER -84.06 131.46 34.8 Favored 'General case' 0 N--CA 1.397 -3.101 0 N-CA-C 110.128 -0.323 . . . . 0.0 110.128 -167.006 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -72.38 146.51 46.99 Favored 'General case' 0 C--N 1.295 -1.789 0 CA-C-N 115.53 -0.759 . . . . 0.0 111.014 -178.451 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . 0.46 ' HB ' ' OE2' ' A' ' 543' ' ' GLU . 39.1 pt -84.29 -12.02 11.67 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.2 0 N-CA-C 108.741 -0.837 . . . . 0.0 108.741 -178.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.489 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 35.7 t -56.84 -38.54 72.8 Favored 'General case' 0 N--CA 1.428 -1.543 0 CA-C-N 114.675 -1.148 . . . . 0.0 109.869 175.644 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -64.62 -34.45 78.3 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 -179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.53 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -61.95 -39.6 92.66 Favored 'General case' 0 C--O 1.22 -0.489 0 CA-C-N 115.803 -0.635 . . . . 0.0 110.114 176.802 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 56.5 t -71.17 -37.22 65.65 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.115 0 C-N-CA 124.083 0.953 . . . . 0.0 108.729 177.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . 0.489 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.2 mm100 -67.3 -10.48 51.3 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 122.711 0.405 . . . . 0.0 111.119 178.146 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.53 ' HB2' ' O ' ' A' ' 526' ' ' ALA . 4.9 m-85 -71.13 -0.02 8.72 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.786 -0.643 . . . . 0.0 109.645 168.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.53 ' HA ' ' CB ' ' A' ' 536' ' ' ARG . 6.3 p -73.03 15.27 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.568 1.642 0 CA-C-O 122.288 1.042 . . . . 0.0 110.469 174.31 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 529' ' ' TYR . 5.9 t30 -97.12 -24.8 15.58 Favored 'General case' 0 C--N 1.307 -1.269 0 N-CA-C 107.261 -1.385 . . . . 0.0 107.261 174.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 31.8 t -91.75 141.68 28.41 Favored 'General case' 0 N--CA 1.422 -1.865 0 CA-C-N 114.963 -1.017 . . . . 0.0 108.785 -178.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -65.86 -51.04 62.17 Favored 'General case' 0 C--N 1.31 -1.119 0 N-CA-C 113.15 0.796 . . . . 0.0 113.15 -175.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -94.95 -37.83 10.97 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-O 121.145 0.498 . . . . 0.0 111.204 -177.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.412 HD22 ' OH ' ' A' ' 506' ' ' TYR . 45.8 mt -66.32 -21.49 66.26 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.708 -174.135 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.53 ' CB ' ' HA ' ' A' ' 530' ' ' VAL . 36.3 ptt180 -63.47 -46.42 86.29 Favored 'General case' 0 C--N 1.345 0.402 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 176.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -61.21 -49.85 75.47 Favored 'General case' 0 N--CA 1.429 -1.484 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.525 -178.061 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.447 ' O ' ' HB2' ' A' ' 541' ' ' SER . 5.7 m -61.01 -54.52 43.95 Favored 'General case' 0 N--CA 1.431 -1.39 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 -178.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . 0.31 4.2 mm? -65.28 -35.62 81.58 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 114.811 1.411 . . . . 0.0 114.811 -177.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 72.1 mt -72.0 -29.64 33.74 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.941 0 C-N-CA 120.218 -0.593 . . . . 0.0 109.91 176.738 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . 0.447 ' HB2' ' O ' ' A' ' 538' ' ' THR . 73.3 m -57.41 -40.76 78.99 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-O 121.669 0.747 . . . . 0.0 109.544 168.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.401 HD12 ' HA ' ' A' ' 475' ' ' ALA . 3.3 mm? -74.67 -13.08 60.58 Favored 'General case' 0 CA--C 1.554 1.126 0 N-CA-C 113.574 0.953 . . . . 0.0 113.574 174.054 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . 0.46 ' OE2' ' HB ' ' A' ' 523' ' ' ILE . 53.9 mm-40 -80.47 -40.75 25.63 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.246 0.546 . . . . 0.0 111.146 174.75 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -77.58 27.36 0.17 Allowed 'General case' 0 CA--C 1.557 1.224 0 N-CA-C 113.856 1.058 . . . . 0.0 113.856 -176.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 17.4 p90 -67.84 163.7 21.31 Favored 'General case' 0 C--O 1.242 0.705 0 O-C-N 122.237 -0.289 . . . . 0.0 110.688 177.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 46.3 m-80 -93.1 155.02 17.76 Favored 'General case' 0 C--N 1.316 -0.89 0 C-N-CA 120.876 -0.329 . . . . 0.0 111.307 -177.1 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 88.2 mt -77.47 22.05 0.25 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.431 1.092 . . . . 0.0 111.952 -179.353 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . 0.452 ' C ' ' H ' ' A' ' 550' ' ' GLU . 2.6 t-20 -79.8 21.32 0.55 Allowed 'General case' 0 CA--C 1.559 1.325 0 CA-C-O 122.082 0.944 . . . . 0.0 110.183 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -70.08 9.65 0.53 Allowed 'General case' 0 N--CA 1.492 1.672 0 C-N-CA 125.601 1.56 . . . . 0.0 111.626 178.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.452 ' H ' ' C ' ' A' ' 548' ' ' ASN . 34.9 mt-10 -54.9 154.66 9.33 Favored Pre-proline 0 CA--C 1.555 1.156 0 C-N-CA 125.917 1.687 . . . . 0.0 111.873 -175.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_exo -71.83 45.16 0.7 Allowed 'Trans proline' 0 N--CA 1.503 2.033 0 C-N-CA 124.666 3.577 . . . . 0.0 112.807 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 50.9 m-85 -134.92 50.49 2.16 Favored 'General case' 0 C--N 1.282 -2.334 0 N-CA-C 104.959 -2.237 . . . . 0.0 104.959 178.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -56.66 67.35 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 117.153 2.279 . . . . 0.0 117.153 -169.679 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . 0.455 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 7.6 t30 -70.65 -22.08 62.54 Favored 'General case' 0 C--N 1.306 -1.322 0 C-N-CA 124.919 1.287 . . . . 0.0 107.786 171.275 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -44.93 -54.53 6.39 Favored 'General case' 0 CA--C 1.553 1.092 0 C-N-CA 125.537 1.535 . . . . 0.0 110.029 177.043 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 54.6 mt -62.7 -38.86 82.74 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 C-N-CA 123.396 0.678 . . . . 0.0 110.284 179.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . 0.455 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 3.2 t70 -56.57 -51.25 69.32 Favored 'General case' 0 N--CA 1.486 1.329 0 CA-C-O 121.071 0.462 . . . . 0.0 110.611 177.416 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . 0.501 ' O ' HG23 ' A' ' 562' ' ' VAL . 29.6 t70 -67.13 -47.41 71.17 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.999 -179.66 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . 0.409 ' O ' HD13 ' A' ' 563' ' ' ILE . 77.6 t80 -51.99 -53.37 42.48 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 124.998 1.319 . . . . 0.0 111.456 179.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.3 t -60.28 -44.24 95.26 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.03 0 CA-C-N 116.538 -0.301 . . . . 0.0 110.679 179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.488 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 9.3 t30 -63.09 -36.33 83.22 Favored 'General case' 0 C--N 1.309 -1.159 0 C-N-CA 122.774 0.43 . . . . 0.0 112.143 179.461 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . 0.501 HG23 ' O ' ' A' ' 558' ' ' ASP . 89.7 t -70.97 -50.3 43.78 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.857 0 CA-C-O 121.591 0.71 . . . . 0.0 111.493 178.093 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.54 ' O ' ' HG3' ' A' ' 566' ' ' LYS . 1.7 mp -80.7 -55.5 8.34 Favored 'Isoleucine or valine' 0 CA--C 1.476 -1.882 0 CA-C-N 114.817 -1.083 . . . . 0.0 110.465 -168.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -74.57 1.09 12.88 Favored 'General case' 0 C--N 1.312 -1.03 0 CA-C-O 122.091 0.948 . . . . 0.0 111.041 -173.265 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.488 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 45.2 tt0 -67.2 -14.71 63.17 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 107.183 -1.414 . . . . 0.0 107.183 169.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . 0.54 ' HG3' ' O ' ' A' ' 563' ' ' ILE . 0.1 OUTLIER -58.11 -18.4 24.83 Favored 'General case' 0 C--N 1.357 0.931 0 CA-C-N 115.688 -0.687 . . . . 0.0 112.781 173.547 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . 119.31 123.29 3.15 Favored Glycine 0 N--CA 1.426 -1.967 0 C-N-CA 120.169 -1.015 . . . . 0.0 113.112 176.093 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -164.74 -86.2 0.02 OUTLIER 'General case' 0 C--N 1.309 -1.174 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 173.905 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -107.71 -173.08 2.2 Favored 'General case' 0 C--N 1.317 -0.805 0 CA-C-N 116.799 -0.182 . . . . 0.0 110.664 -177.911 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . 0.459 ' O ' ' HG ' ' A' ' 574' ' ' LEU . 42.5 m -88.96 161.59 16.54 Favored 'General case' 0 C--N 1.312 -1.047 0 N-CA-C 109.968 -0.382 . . . . 0.0 109.968 -178.658 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.703 ' HA ' HD12 ' A' ' 574' ' ' LEU . 18.4 tt -53.65 -38.12 33.52 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.086 0 C-N-CA 123.695 0.798 . . . . 0.0 112.879 -179.465 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . 0.412 ' HA ' ' OD1' ' A' ' 575' ' ' ASN . 35.9 mt-10 -75.04 -32.51 61.57 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 121.611 0.72 . . . . 0.0 110.318 -176.419 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 9.7 m -66.1 -39.48 90.01 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 176.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.703 HD12 ' HA ' ' A' ' 571' ' ' ILE . 59.0 mt -58.97 -43.39 91.33 Favored 'General case' 0 C--O 1.205 -1.269 0 CA-C-N 115.034 -0.985 . . . . 0.0 109.153 175.443 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . 0.412 ' OD1' ' HA ' ' A' ' 572' ' ' GLU . 13.8 m120 -51.93 -48.72 64.1 Favored 'General case' 0 N--CA 1.472 0.666 0 O-C-N 123.806 0.691 . . . . 0.0 111.496 -177.819 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -63.32 -40.66 97.93 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 120.236 -0.585 . . . . 0.0 110.933 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 16.5 tppt? -66.85 -41.96 86.51 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.301 -179.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.555 ' HG ' ' O ' ' A' ' 574' ' ' LEU . 88.2 mt -54.99 -57.26 12.39 Favored 'General case' 0 CA--C 1.482 -1.647 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.515 178.875 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.642 ' CB ' ' HB3' ' A' ' 593' ' ' TYR . 0.2 OUTLIER -62.39 -25.73 68.09 Favored 'General case' 0 N--CA 1.434 -1.244 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -178.719 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . 0.489 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 34.3 tt0 -68.9 -39.53 79.68 Favored 'General case' 0 C--N 1.31 -1.131 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 175.169 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -65.84 -47.87 73.53 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-O 121.103 0.478 . . . . 0.0 110.502 174.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.417 ' C ' ' H ' ' A' ' 584' ' ' ILE . 14.3 m -60.9 -25.53 66.8 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 124.822 1.249 . . . . 0.0 112.041 -178.856 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.489 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 6.6 tpm_? -48.11 -6.99 0.02 OUTLIER 'General case' 0 CA--C 1.571 1.757 0 C-N-CA 126.437 1.895 . . . . 0.0 113.102 174.982 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.417 ' H ' ' C ' ' A' ' 582' ' ' THR . 16.4 tt -70.16 -18.19 21.45 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.292 0 C-N-CA 123.612 0.765 . . . . 0.0 111.887 -177.329 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 127.54 16.48 2.28 Favored Glycine 0 CA--C 1.533 1.177 0 N-CA-C 118.879 2.312 . . . . 0.0 118.879 171.302 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -85.08 109.08 17.98 Favored 'General case' 0 C--O 1.2 -1.534 0 CA-C-N 119.879 1.839 . . . . 0.0 107.231 170.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 9.1 p -53.87 -43.24 56.4 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 N-CA-C 114.358 1.244 . . . . 0.0 114.358 -171.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -66.95 -55.76 13.17 Favored 'General case' 0 C--O 1.245 0.837 0 CA-C-O 121.096 0.474 . . . . 0.0 110.568 -176.226 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -69.54 -34.2 73.87 Favored 'General case' 0 C--O 1.198 -1.649 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.661 -178.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . 0.585 ' O ' ' HG ' ' A' ' 594' ' ' LEU . 29.5 tt0 -58.5 -47.79 82.95 Favored 'General case' 0 C--O 1.198 -1.637 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 176.948 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -62.76 -46.09 89.64 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.527 0.68 . . . . 0.0 109.798 179.682 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.662 ' O ' ' HB2' ' A' ' 595' ' ' GLN . 73.6 t80 -56.58 -50.5 71.75 Favored 'General case' 0 CA--C 1.544 0.736 0 CA-C-O 124.042 1.877 . . . . 0.0 108.821 176.23 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . 0.642 ' HB3' ' CB ' ' A' ' 579' ' ' ARG 0.307 18.6 m-85 -67.19 -27.69 67.48 Favored 'General case' 0 C--N 1.247 -3.88 0 N-CA-C 114.471 1.285 . . . . 0.0 114.471 177.888 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.625 ' O ' ' HB ' ' A' ' 597' ' ' ILE 0.315 12.1 mt -69.3 -19.85 63.9 Favored 'General case' 0 C--N 1.293 -1.86 0 O-C-N 120.118 -1.614 . . . . 0.0 111.937 174.313 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.662 ' HB2' ' O ' ' A' ' 592' ' ' TYR 0.289 42.6 mt-30 -61.68 -40.91 96.64 Favored 'General case' 0 CA--C 1.482 -1.671 0 N-CA-C 107.667 -1.235 . . . . 0.0 107.667 164.763 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . 0.424 ' HA ' ' HB3' ' A' ' 599' ' ' ALA . 2.3 mp0 -63.95 -16.49 61.63 Favored 'General case' 0 CA--C 1.561 1.374 0 CA-C-N 115.068 -0.969 . . . . 0.0 112.026 174.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.625 ' HB ' ' O ' ' A' ' 594' ' ' LEU . 48.2 mt -60.5 -46.86 94.74 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.523 0 N-CA-C 107.053 -1.462 . . . . 0.0 107.053 164.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . 0.431 ' HB ' ' O ' ' A' ' 595' ' ' GLN . 59.0 t -62.38 -35.41 69.46 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.09 0 CA-C-N 114.795 -1.093 . . . . 0.0 109.72 175.582 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.699 ' O ' ' HG2' ' A' ' 602' ' ' LYS . . . -64.42 -29.8 70.85 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-O 121.091 0.472 . . . . 0.0 111.211 173.743 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -66.44 -36.21 82.23 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 174.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 10.0 t30 -68.88 -36.39 78.01 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-N 115.012 -0.995 . . . . 0.0 110.754 177.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.699 ' HG2' ' O ' ' A' ' 599' ' ' ALA . 51.5 pttt -69.31 -27.19 65.17 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.093 0.473 . . . . 0.0 109.797 179.574 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -75.08 -39.96 60.41 Favored 'General case' 0 N--CA 1.45 -0.445 0 CA-C-O 121.721 0.772 . . . . 0.0 109.172 175.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 60.4 ttp180 -73.07 -35.24 66.62 Favored 'General case' 0 C--N 1.317 -0.839 0 CA-C-N 114.804 -1.089 . . . . 0.0 111.355 -178.361 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 21.4 ttt . . . . . 0 C--N 1.291 -1.949 0 N-CA-C 108.501 -0.926 . . . . 0.0 108.501 -177.173 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 1.8 p90 . . . . . 0 N--CA 1.429 -1.502 0 N-CA-C 111.951 0.352 . . . . 0.0 111.951 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 24.7 m-20 -82.51 146.55 29.17 Favored 'General case' 0 C--N 1.311 -1.092 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 175.707 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 31.7 p30 -92.71 46.51 1.24 Allowed 'General case' 0 C--N 1.31 -1.124 0 CA-C-O 122.199 1.0 . . . . 0.0 110.531 -177.276 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 91.5 mt -66.83 102.73 0.99 Allowed 'General case' 0 C--N 1.308 -1.233 0 CA-C-N 113.995 -1.457 . . . . 0.0 111.505 -179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 41.0 t -109.53 104.16 13.17 Favored 'General case' 0 N--CA 1.418 -2.067 0 N-CA-C 106.106 -1.813 . . . . 0.0 106.106 173.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 18.5 ptt180 -70.81 -29.13 65.22 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 120.551 -0.46 . . . . 0.0 112.2 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -67.65 -54.3 20.77 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.924 -0.58 . . . . 0.0 111.057 -179.37 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.624 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 32.0 tt0 -63.48 -36.67 84.51 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 -179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 55.6 tptt -58.18 -42.43 86.06 Favored 'General case' 0 C--O 1.241 0.651 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.483 177.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -65.65 -43.43 89.42 Favored 'General case' 0 N--CA 1.448 -0.542 0 CA-C-N 115.814 -0.63 . . . . 0.0 110.089 -179.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -59.72 -44.5 93.7 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.457 0.703 . . . . 0.0 110.924 178.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.624 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 92.4 mtt180 -53.46 -54.27 39.4 Favored 'General case' 0 C--O 1.238 0.49 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.296 179.222 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . 0.438 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -69.56 -43.47 72.83 Favored 'General case' 0 C--O 1.218 -0.568 0 O-C-N 124.146 0.903 . . . . 0.0 112.265 -178.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -55.12 -36.65 65.95 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 124.019 0.927 . . . . 0.0 111.727 -176.041 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.494 HD11 HG11 ' A' ' 507' ' ' VAL . 1.2 tm? -57.38 -31.34 65.7 Favored 'General case' 0 C--N 1.311 -1.109 0 CA-C-N 113.866 -1.516 . . . . 0.0 111.277 -176.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.477 ' HD3' ' O ' ' A' ' 542' ' ' LEU . 12.4 pttt -71.65 -19.87 62.03 Favored 'General case' 0 CA--C 1.545 0.782 0 N-CA-C 112.818 0.673 . . . . 0.0 112.818 -172.61 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.4 ' N ' ' HG3' ' A' ' 478' ' ' LYS . 9.0 t-160 -119.92 9.09 11.18 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 118.239 -1.384 . . . . 0.0 112.832 -171.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.498 ' HB2' HG23 ' A' ' 486' ' ' THR 0.264 1.1 pp -91.58 72.07 5.91 Favored 'General case' 0 C--O 1.194 -1.83 0 CA-C-O 122.739 1.256 . . . . 0.0 110.982 175.812 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -98.67 9.45 43.29 Favored 'General case' 0 C--N 1.3 -1.552 0 N-CA-C 114.19 1.182 . . . . 0.0 114.19 -178.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . 0.651 ' O ' ' HG2' ' A' ' 520' ' ' GLN . 97.7 mtt180 -66.56 -97.8 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.504 0 CA-C-N 119.946 1.248 . . . . 0.0 114.282 -171.16 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . 0.278 1.1 p30 -143.64 -84.87 0.15 Allowed 'General case' 0 N--CA 1.48 1.051 0 N-CA-C 117.034 2.235 . . . . 0.0 117.034 168.354 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 41.9 mtmt -95.43 -41.3 9.05 Favored 'General case' 0 CA--C 1.485 -1.551 0 CA-C-O 121.893 0.854 . . . . 0.0 109.414 -178.382 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . 0.471 ' O ' ' HB2' ' A' ' 489' ' ' ASN . 9.7 p-10 -51.1 -38.4 51.6 Favored 'General case' 0 C--O 1.173 -2.965 0 CA-C-N 112.683 -2.053 . . . . 0.0 109.211 179.712 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.498 HG23 ' HB2' ' A' ' 480' ' ' LEU . 3.1 m -59.05 -51.44 70.03 Favored 'General case' 0 N--CA 1.419 -1.98 0 C-N-CA 125.907 1.683 . . . . 0.0 113.343 -179.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 19.4 t80 -66.13 -44.72 83.44 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 108.719 -0.845 . . . . 0.0 108.719 -174.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 59.4 mt -76.33 -21.75 55.8 Favored 'General case' 0 C--N 1.305 -1.337 0 CA-C-N 115.259 -0.882 . . . . 0.0 110.356 -178.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . 0.471 ' HB2' ' O ' ' A' ' 485' ' ' ASP . 57.7 t30 -65.6 -40.39 92.59 Favored 'General case' 0 CA--C 1.494 -1.177 0 C-N-CA 123.008 0.523 . . . . 0.0 109.97 -177.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 30.5 t80 -83.96 -54.31 4.96 Favored 'General case' 0 N--CA 1.425 -1.704 0 C-N-CA 119.19 -1.004 . . . . 0.0 109.749 175.844 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 32.4 t80 -58.92 -35.96 73.96 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 114.849 1.425 . . . . 0.0 114.849 -171.397 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -83.23 -23.14 32.89 Favored 'General case' 0 CA--C 1.547 0.848 0 CA-C-O 121.347 0.594 . . . . 0.0 111.347 179.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 15.8 m -83.98 -41.67 17.06 Favored 'General case' 0 C--N 1.306 -1.293 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 -175.049 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 40.0 t -101.87 161.73 3.74 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 CA-C-N 116.407 -0.36 . . . . 0.0 110.361 -173.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -90.81 101.95 14.7 Favored 'General case' 0 CA--C 1.495 -1.169 0 CA-C-O 121.1 0.476 . . . . 0.0 111.352 177.404 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 65.3 pttt -57.99 -36.81 73.16 Favored 'General case' 0 C--N 1.318 -0.771 0 CA-C-N 114.709 -1.132 . . . . 0.0 111.929 -176.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -73.74 -28.35 61.65 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 112.662 0.616 . . . . 0.0 112.662 -176.86 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.6 m120 -83.36 -56.64 3.64 Favored 'General case' 0 C--N 1.307 -1.27 0 CA-C-O 121.744 0.783 . . . . 0.0 109.113 -179.139 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 93.6 m-85 -77.57 11.64 1.96 Allowed 'General case' 0 C--N 1.301 -1.502 0 N-CA-C 115.256 1.576 . . . . 0.0 115.256 -174.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 5.1 m -52.5 99.88 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.716 0 CA-C-O 121.753 0.787 . . . . 0.0 111.896 -173.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.492 ' HB3' ' CD2' ' A' ' 504' ' ' PHE . 23.2 t-20 -119.3 154.76 33.01 Favored 'General case' 0 C--N 1.31 -1.151 0 N-CA-C 107.499 -1.297 . . . . 0.0 107.499 178.569 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 47.5 tp60 -58.99 -31.8 69.1 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 123.715 0.806 . . . . 0.0 110.312 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 2.8 t-160 -59.01 -53.96 52.46 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 124.181 0.992 . . . . 0.0 108.685 179.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . 0.492 ' CD2' ' HB3' ' A' ' 501' ' ' ASN . 22.0 m-85 -66.42 -35.1 79.47 Favored 'General case' 0 C--N 1.294 -1.833 0 CA-C-N 114.128 -1.396 . . . . 0.0 111.425 -178.209 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -64.36 -49.34 72.01 Favored 'General case' 0 CA--C 1.504 -0.801 0 C-N-CA 123.199 0.599 . . . . 0.0 110.269 -176.83 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.53 ' O ' HG23 ' A' ' 510' ' ' VAL . 9.2 m-85 -60.09 -54.87 40.81 Favored 'General case' 0 N--CA 1.439 -0.991 0 O-C-N 123.855 0.722 . . . . 0.0 111.953 178.477 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . 0.494 HG11 HD11 ' A' ' 477' ' ' LEU . 54.5 t -60.48 -48.04 90.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.484 0 CA-C-N 116.213 -0.449 . . . . 0.0 111.349 -176.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -49.69 -50.31 44.19 Favored 'General case' 0 C--O 1.218 -0.567 0 O-C-N 123.568 0.543 . . . . 0.0 111.117 176.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -63.46 -53.73 47.65 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.53 HG23 ' O ' ' A' ' 506' ' ' TYR . 42.8 t -57.96 -45.95 87.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 CA-C-O 121.217 0.532 . . . . 0.0 110.407 -178.239 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.485 ' HB2' ' O ' ' A' ' 507' ' ' VAL . 0.4 OUTLIER -66.4 -48.66 69.36 Favored 'General case' 0 N--CA 1.419 -2.001 0 CA-C-N 115.02 -0.991 . . . . 0.0 109.976 -176.352 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 14.2 t60 -60.01 -42.96 95.45 Favored 'General case' 0 N--CA 1.466 0.363 0 C-N-CA 123.152 0.581 . . . . 0.0 110.651 -179.218 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 7.4 t70 -71.15 -43.34 67.73 Favored 'General case' 0 C--N 1.313 -0.991 0 O-C-N 123.405 0.441 . . . . 0.0 112.179 -173.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . 0.412 ' HA ' ' HG2' ' A' ' 517' ' ' GLU . 65.1 m-85 -73.92 -42.16 61.02 Favored 'General case' 0 C--O 1.199 -1.605 0 C-N-CA 119.289 -0.964 . . . . 0.0 111.607 177.107 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -54.74 -32.06 59.24 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.454 0.701 . . . . 0.0 110.311 176.702 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -70.23 -24.37 63.08 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.579 -0.737 . . . . 0.0 112.409 177.751 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.412 ' HG2' ' HA ' ' A' ' 514' ' ' PHE . 10.0 pt-20 -110.03 -44.05 3.86 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 112.617 0.599 . . . . 0.0 112.617 -176.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . 0.408 ' HB3' ' H ' ' A' ' 519' ' ' ASP . 92.1 m-20 -135.38 -152.16 0.45 Allowed 'General case' 0 C--N 1.302 -1.492 0 C-N-CA 124.355 1.062 . . . . 0.0 109.592 -172.622 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . 0.408 ' H ' ' HB3' ' A' ' 518' ' ' ASN . 3.4 p-10 -79.32 -164.54 0.64 Allowed 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 125.093 1.357 . . . . 0.0 111.683 -179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . 0.651 ' HG2' ' O ' ' A' ' 482' ' ' ARG . 0.0 OUTLIER -73.78 -178.79 3.33 Favored 'General case' 0 C--N 1.312 -1.04 0 N-CA-C 115.933 1.827 . . . . 0.0 115.933 -171.227 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . 0.433 ' CB ' ' HG ' ' A' ' 511' ' ' LEU . 12.0 t80 -103.21 138.03 40.56 Favored 'General case' 1 N--CA 1.362 -4.863 0 C-N-CA 125.384 1.473 . . . . 0.0 107.49 -177.321 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 33.2 m-80 -118.99 167.79 11.42 Favored 'General case' 0 C--N 1.291 -1.936 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 178.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.6 pp -70.36 -8.63 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.334 0 CA-C-O 121.512 0.672 . . . . 0.0 110.726 178.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 12.8 m -56.19 -40.47 74.01 Favored 'General case' 0 N--CA 1.426 -1.63 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.787 173.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 6.6 t70 -71.41 -40.51 70.42 Favored 'General case' 0 N--CA 1.457 -0.085 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 179.062 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.455 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -59.29 -48.11 82.86 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 115.252 -0.886 . . . . 0.0 111.878 179.602 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.672 ' O ' HG12 ' A' ' 530' ' ' VAL . 10.3 p -67.65 -28.55 42.19 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.854 0 CA-C-O 121.314 0.578 . . . . 0.0 110.71 177.463 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -70.7 -20.77 62.64 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 109.398 -0.593 . . . . 0.0 109.398 175.004 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.6 ' O ' ' HG2' ' A' ' 536' ' ' ARG . 2.0 m-85 -74.57 -23.41 58.76 Favored 'General case' 0 CA--C 1.494 -1.184 0 N-CA-C 112.968 0.729 . . . . 0.0 112.968 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.672 HG12 ' O ' ' A' ' 527' ' ' VAL . 10.0 p -74.03 52.57 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.898 0 CA-C-O 123.226 1.488 . . . . 0.0 114.839 -171.932 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 38.0 t30 -107.64 -34.14 7.09 Favored 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 106.05 -1.833 . . . . 0.0 106.05 173.483 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.54 144.79 25.43 Favored 'General case' 0 N--CA 1.424 -1.737 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 171.198 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . 0.257 7.2 p30 -76.34 -69.0 0.53 Allowed 'General case' 0 C--N 1.307 -1.255 0 N-CA-C 116.796 2.147 . . . . 0.0 116.796 -168.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . 0.401 ' CD ' ' H ' ' A' ' 535' ' ' LEU 0.258 0.0 OUTLIER -50.24 -73.16 0.04 OUTLIER 'General case' 0 C--N 1.307 -1.267 0 N-CA-C 117.479 2.4 . . . . 0.0 117.479 -164.911 . . . . . . . . 4 4 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.401 ' H ' ' CD ' ' A' ' 534' ' ' GLU . 58.8 tp -71.91 -31.98 66.94 Favored 'General case' 0 C--N 1.28 -2.453 0 CA-C-O 121.646 0.736 . . . . 0.0 111.236 -172.075 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.6 ' HG2' ' O ' ' A' ' 529' ' ' TYR . 8.2 mpt_? -75.02 -44.0 50.48 Favored 'General case' 0 C--N 1.294 -1.816 0 CA-C-N 114.827 -1.079 . . . . 0.0 111.34 -173.741 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -60.73 -40.21 91.5 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.31 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.465 ' O ' HD13 ' A' ' 542' ' ' LEU . 57.2 m -54.38 -49.14 70.56 Favored 'General case' 0 N--CA 1.436 -1.149 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.908 178.467 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . 0.438 HD13 ' HA ' ' A' ' 539' ' ' LEU . 4.1 mm? -59.17 -38.24 79.29 Favored 'General case' 0 N--CA 1.47 0.544 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 177.402 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 49.9 mm -68.29 -40.67 82.93 Favored 'Isoleucine or valine' 0 C--N 1.308 -1.205 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.775 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 35.2 t -58.47 -45.46 88.61 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 116.088 -0.506 . . . . 0.0 109.696 174.003 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.477 ' O ' ' HD3' ' A' ' 478' ' ' LYS . 6.8 mp -64.78 -30.08 71.07 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 115.604 -0.726 . . . . 0.0 111.959 177.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . 0.457 ' HA ' ' CD ' ' A' ' 478' ' ' LYS . 0.2 OUTLIER -76.29 -34.4 59.09 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.009 -0.738 . . . . 0.0 109.009 177.893 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 60.4 tt0 -62.67 -36.11 81.83 Favored 'General case' 0 CA--C 1.515 -0.396 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.374 179.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 40.0 t80 -67.67 113.39 5.42 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 108.466 -0.938 . . . . 0.0 108.466 172.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 7.9 p30 -134.52 103.08 5.54 Favored 'General case' 0 C--N 1.302 -1.484 0 CA-C-O 121.962 0.887 . . . . 0.0 111.929 -178.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.427 ' HG ' ' ND2' ' A' ' 554' ' ' ASN . 40.8 tp -91.85 -12.54 33.36 Favored 'General case' 0 C--N 1.314 -0.977 0 CA-C-N 114.67 -1.15 . . . . 0.0 109.591 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -70.1 18.94 0.05 OUTLIER 'General case' 0 CA--C 1.559 1.31 0 N-CA-C 115.693 1.738 . . . . 0.0 115.693 -173.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -68.76 -31.39 70.39 Favored 'General case' 0 N--CA 1.488 1.442 0 CA-C-O 121.65 0.738 . . . . 0.0 112.11 -179.638 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.483 ' HB2' ' HD2' ' A' ' 551' ' ' PRO . 12.5 pt-20 -95.71 -178.97 0.84 Allowed Pre-proline 0 C--N 1.3 -1.582 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 178.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . 0.483 ' HD2' ' HB2' ' A' ' 550' ' ' GLU . 83.9 Cg_exo -47.6 137.85 19.89 Favored 'Trans proline' 0 C--N 1.386 2.527 0 C-N-CA 121.811 1.674 . . . . 0.0 110.299 175.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 42.6 m-85 -74.01 4.73 5.04 Favored 'General case' 0 N--CA 1.481 1.093 0 CA-C-O 121.908 0.861 . . . . 0.0 112.866 -167.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . 0.473 ' HA ' HG12 ' A' ' 556' ' ' ILE . 1.9 mp0 -74.94 -12.6 60.39 Favored 'General case' 0 N--CA 1.408 -2.565 0 CA-C-N 115.665 -0.698 . . . . 0.0 110.859 176.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . 0.427 ' ND2' ' HG ' ' A' ' 547' ' ' LEU . 28.0 p-10 -69.75 -24.4 63.53 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 109.194 -0.669 . . . . 0.0 109.194 175.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 51.5 mt-10 -80.34 -56.38 4.24 Favored 'General case' 0 N--CA 1.438 -1.058 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 -177.304 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . 0.473 HG12 ' HA ' ' A' ' 553' ' ' GLU . 34.0 pt -64.69 -38.24 82.16 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.87 179.448 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . 0.527 ' HA ' HH21 ' A' ' 579' ' ' ARG . 36.2 t70 -63.94 -45.08 90.77 Favored 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 12.4 t70 -65.37 -45.78 82.73 Favored 'General case' 0 CA--C 1.506 -0.72 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -56.22 -52.58 63.92 Favored 'General case' 0 N--CA 1.437 -1.118 0 CA-C-N 113.985 -1.461 . . . . 0.0 111.291 178.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . 0.477 HG13 ' CE1' ' A' ' 576' ' ' HIS . 13.2 p -65.94 -36.01 76.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 C-N-CA 121.047 -0.261 . . . . 0.0 111.353 -179.283 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.515 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 27.3 t-20 -62.55 -32.73 73.73 Favored 'General case' 0 N--CA 1.491 1.584 0 CA-C-O 121.349 0.595 . . . . 0.0 110.232 176.529 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 70.2 t -77.35 -56.94 6.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.349 0 CA-C-N 115.553 -0.748 . . . . 0.0 112.522 175.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . . . . . . . . . 50.7 mm -74.77 -49.74 28.49 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.272 0 CA-C-N 115.5 -0.773 . . . . 0.0 111.418 -169.301 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 12.6 t30 -80.78 -3.29 50.45 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.575 -174.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.515 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 29.4 tt0 -64.11 -32.75 74.43 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 168.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -103.22 30.0 5.18 Favored 'General case' 0 C--N 1.317 -0.838 0 CA-C-N 114.963 -1.017 . . . . 0.0 109.046 174.754 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -125.59 -84.01 0.54 Allowed Glycine 0 N--CA 1.423 -2.208 0 C-N-CA 120.202 -0.999 . . . . 0.0 114.04 -174.795 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -139.89 -3.79 1.42 Allowed 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 114.18 1.178 . . . . 0.0 114.18 -171.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -86.92 122.45 30.79 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 118.47 -1.292 . . . . 0.0 114.346 -172.537 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 7.5 t -137.9 -53.98 0.65 Allowed 'General case' 0 CA--C 1.561 1.375 0 CA-C-N 114.856 -1.065 . . . . 0.0 109.704 179.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 11.5 tt -90.8 -38.34 10.6 Favored 'Isoleucine or valine' 0 N--CA 1.437 -1.109 0 CA-C-O 122.419 1.105 . . . . 0.0 108.358 177.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . 0.435 ' H ' ' CD ' ' A' ' 572' ' ' GLU . 0.7 OUTLIER -74.95 -20.13 59.81 Favored 'General case' 0 C--O 1.196 -1.736 0 CA-C-N 114.038 -1.437 . . . . 0.0 111.243 179.501 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 66.9 p -63.63 -31.34 72.48 Favored 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 179.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 69.6 mt -63.15 -55.25 26.8 Favored 'General case' 0 C--O 1.24 0.565 0 CA-C-N 115.142 -0.935 . . . . 0.0 108.785 175.056 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . 0.49 ' HB3' ' HA ' ' A' ' 598' ' ' VAL . 2.6 m-20 -62.84 -35.11 78.87 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.251 179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . 0.477 ' CE1' HG13 ' A' ' 560' ' ' VAL . 20.9 t-160 -63.47 -34.94 78.86 Favored 'General case' 0 C--N 1.309 -1.183 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.259 176.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 43.5 tptt -60.52 -45.59 93.27 Favored 'General case' 0 C--O 1.239 0.519 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 176.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 9.6 mp -54.85 -41.93 71.36 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.779 172.417 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.714 ' O ' ' HB ' ' A' ' 582' ' ' THR . 14.1 ttt180 -63.18 -31.71 72.92 Favored 'General case' 0 CA--C 1.56 1.344 0 N-CA-C 113.201 0.815 . . . . 0.0 113.201 174.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 76.1 tt0 -66.16 -45.11 82.1 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 108.274 -1.01 . . . . 0.0 108.274 175.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -63.37 -22.06 66.65 Favored 'General case' 0 CA--C 1.549 0.914 0 CA-C-O 121.833 0.825 . . . . 0.0 110.643 174.776 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.714 ' HB ' ' O ' ' A' ' 579' ' ' ARG . 16.3 m -67.8 -36.99 81.42 Favored 'General case' 0 C--N 1.313 -1.016 0 C-N-CA 124.167 0.987 . . . . 0.0 111.124 176.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . . . . . . . . . 23.2 ttm180 -56.68 -7.34 0.42 Allowed 'General case' 0 CA--C 1.57 1.732 0 C-N-CA 125.413 1.485 . . . . 0.0 113.66 -178.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 14.5 tt -72.25 -24.25 22.15 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.139 0 O-C-N 121.219 -0.925 . . . . 0.0 110.858 -175.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 119.76 -56.5 0.59 Allowed Glycine 0 CA--C 1.524 0.621 0 N-CA-C 117.859 1.904 . . . . 0.0 117.859 169.312 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . 0.445 ' HA ' ' HG2' ' A' ' 588' ' ' GLU . 13.0 t70 -143.94 59.06 1.36 Allowed 'General case' 0 N--CA 1.481 1.117 0 CA-C-N 119.712 1.756 . . . . 0.0 113.765 -172.163 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.624 HG12 ' HB2' ' A' ' 590' ' ' GLN . 2.4 t -94.36 17.59 1.51 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.214 0 N-CA-C 106.862 -1.533 . . . . 0.0 106.862 164.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.492 ' HA ' ' HB3' ' A' ' 591' ' ' LYS . 10.1 mm-40 -33.31 -35.63 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 129.016 2.926 . . . . 0.0 118.804 -158.416 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 6.4 tt -68.73 -61.68 1.71 Allowed 'General case' 0 C--N 1.283 -2.319 0 N-CA-C 106.807 -1.553 . . . . 0.0 106.807 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . 0.624 ' HB2' HG12 ' A' ' 587' ' ' VAL . 81.6 mm-40 -57.58 -44.38 85.28 Favored 'General case' 0 C--N 1.312 -1.061 0 CA-C-N 113.803 -1.544 . . . . 0.0 109.419 176.479 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.546 ' HD3' ' HA ' ' A' ' 582' ' ' THR . 0.3 OUTLIER -60.06 -42.99 95.68 Favored 'General case' 0 C--O 1.218 -0.554 0 CA-C-N 114.022 -1.445 . . . . 0.0 110.028 -175.483 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.497 ' HA ' HE21 ' A' ' 595' ' ' GLN . 85.5 t80 -53.7 -54.39 38.57 Favored 'General case' 0 CA--C 1.504 -0.818 0 O-C-N 124.271 0.982 . . . . 0.0 109.69 177.771 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . 0.556 ' O ' HG13 ' A' ' 597' ' ' ILE . 84.5 m-85 -62.92 -45.91 90.25 Favored 'General case' 0 C--N 1.315 -0.922 0 CA-C-N 116.089 -0.505 . . . . 0.0 112.116 179.274 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.469 ' O ' ' HB ' ' A' ' 597' ' ' ILE . 88.7 mt -60.9 -50.45 73.35 Favored 'General case' 0 C--O 1.252 1.188 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.178 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.512 ' HG3' ' O ' ' A' ' 591' ' ' LYS 0.423 3.6 pp0? -70.93 -24.55 62.47 Favored 'General case' 0 N--CA 1.438 -1.058 0 C-N-CA 119.207 -0.997 . . . . 0.0 113.471 177.955 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -71.63 -25.34 62.11 Favored 'General case' 0 N--CA 1.445 -0.686 0 C-N-CA 119.351 -0.94 . . . . 0.0 111.048 171.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.556 HG13 ' O ' ' A' ' 593' ' ' TYR . 74.6 mt -59.49 -51.6 70.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 171.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . 0.626 ' O ' ' HG2' ' A' ' 602' ' ' LYS . 12.4 p -65.06 -33.65 65.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.769 0 C-N-CA 119.363 -0.935 . . . . 0.0 110.865 176.589 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.474 ' HA ' ' HE3' ' A' ' 602' ' ' LYS . . . -58.02 -43.57 86.82 Favored 'General case' 0 C--O 1.216 -0.659 0 O-C-N 123.134 0.271 . . . . 0.0 110.572 177.205 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 88.3 tttt -63.14 -43.25 98.88 Favored 'General case' 0 C--N 1.309 -1.156 0 CA-C-N 115.5 -0.773 . . . . 0.0 110.218 179.696 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . 0.624 ' O ' ' HB3' ' A' ' 604' ' ' ARG . 22.3 t-20 -66.47 -44.99 81.21 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.074 -0.512 . . . . 0.0 112.195 -179.405 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.626 ' HG2' ' O ' ' A' ' 598' ' ' VAL . 33.4 pttt -71.86 -29.93 64.9 Favored 'General case' 0 C--N 1.312 -1.028 0 C-N-CA 120.026 -0.669 . . . . 0.0 111.656 179.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 41.4 tt0 -73.39 -17.73 61.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-O 121.222 0.534 . . . . 0.0 110.052 177.038 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . 0.624 ' HB3' ' O ' ' A' ' 601' ' ' ASN . 0.2 OUTLIER -65.53 -19.67 66.02 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 123.854 0.862 . . . . 0.0 110.221 175.34 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 26.4 ttt . . . . . 0 C--O 1.255 1.365 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 178.087 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 . . . . . 0 C--O 1.237 0.407 0 CA-C-O 120.923 0.392 . . . . 0.0 111.006 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -68.27 138.28 55.38 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.548 178.623 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -135.69 85.74 2.18 Favored 'General case' 0 C--N 1.3 -1.551 0 N-CA-C 108.352 -0.981 . . . . 0.0 108.352 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 82.1 mt -61.62 111.76 1.96 Allowed 'General case' 0 C--N 1.291 -1.975 0 CA-C-O 121.572 0.701 . . . . 0.0 110.529 178.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.7 m -106.12 -170.71 1.77 Allowed 'General case' 0 C--N 1.296 -1.746 0 CA-C-N 114.978 -1.01 . . . . 0.0 110.187 -177.357 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . 0.426 ' O ' ' HB3' ' A' ' 471' ' ' LYS . 39.0 ttm180 -58.22 -24.17 58.29 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 124.199 1.0 . . . . 0.0 111.24 -179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.535 ' NE2' ' HB2' ' A' ' 566' ' ' LYS . 20.9 mp0 -60.11 -24.84 64.98 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.813 -179.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.423 ' O ' ' HB2' ' A' ' 474' ' ' ARG . 8.3 tm-20 -66.48 -34.71 78.55 Favored 'General case' 0 C--O 1.206 -1.227 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.426 ' HB3' ' O ' ' A' ' 468' ' ' ARG . 13.3 tmtt? -66.36 -39.64 89.28 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.526 -0.761 . . . . 0.0 109.327 176.659 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . 0.4 ' HB2' HG11 ' A' ' 562' ' ' VAL . . . -63.37 -49.3 74.39 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.198 -0.455 . . . . 0.0 110.839 178.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . 0.524 ' HG3' ' O ' ' A' ' 469' ' ' GLN . 36.6 mt-10 -67.71 -34.55 77.09 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 115.553 -0.748 . . . . 0.0 109.853 -179.268 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.423 ' HB2' ' O ' ' A' ' 470' ' ' GLU . 37.2 ttp180 -61.08 -45.55 94.26 Favored 'General case' 0 C--O 1.233 0.23 0 C-N-CA 123.987 0.915 . . . . 0.0 109.681 175.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . 0.462 ' HA ' HD23 ' A' ' 542' ' ' LEU . . . -68.3 -41.83 80.36 Favored 'General case' 0 N--CA 1.45 -0.457 0 CA-C-N 115.469 -0.787 . . . . 0.0 111.74 -179.643 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -60.03 -51.06 71.25 Favored 'General case' 0 C--O 1.24 0.589 0 O-C-N 123.677 0.611 . . . . 0.0 110.27 -179.317 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.511 HD21 HG11 ' A' ' 507' ' ' VAL . 1.6 tt -57.8 -38.91 76.36 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 114.623 -1.171 . . . . 0.0 111.861 178.366 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.433 ' HB2' HD11 ' A' ' 539' ' ' LEU . 23.7 tptp -82.39 -13.94 56.01 Favored 'General case' 0 C--N 1.304 -1.4 0 CA-C-N 115.8 -0.636 . . . . 0.0 111.714 -175.216 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.412 ' CE1' ' HB2' ' A' ' 552' ' ' TYR . 6.4 t60 -85.79 -53.86 4.87 Favored 'General case' 0 C--N 1.298 -1.635 0 CA-C-N 115.903 -0.589 . . . . 0.0 112.325 -172.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.597 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 96.0 mt -101.71 107.69 18.99 Favored 'General case' 0 C--N 1.304 -1.389 0 CA-C-O 121.766 0.793 . . . . 0.0 112.719 -173.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 53.1 mtt -94.74 -44.0 7.99 Favored 'General case' 0 C--O 1.251 1.154 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.766 -174.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . 0.458 ' HG2' ' OE1' ' A' ' 520' ' ' GLN . 99.2 mtt180 -70.03 -31.14 68.64 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-O 122.378 1.085 . . . . 0.0 110.848 -179.443 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . 0.597 ' HB2' ' HB3' ' A' ' 480' ' ' LEU . 4.7 m-20 -70.63 61.01 0.23 Allowed 'General case' 0 C--N 1.252 -3.653 0 C-N-CA 127.496 2.318 . . . . 0.0 116.83 -170.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . 0.565 ' HD3' ' OD2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -39.66 -41.51 1.07 Allowed 'General case' 0 N--CA 1.52 3.06 0 N-CA-C 112.035 0.383 . . . . 0.0 112.035 172.329 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -52.21 -52.93 49.32 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 124.053 0.941 . . . . 0.0 110.77 177.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.5 ' O ' ' HB3' ' A' ' 490' ' ' TYR . 68.0 m -64.14 -35.79 81.93 Favored 'General case' 0 N--CA 1.434 -1.254 0 CA-C-N 115.709 -0.678 . . . . 0.0 111.514 178.654 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 14.4 t80 -51.21 -54.07 29.13 Favored 'General case' 0 C--N 1.349 0.578 0 O-C-N 123.12 0.263 . . . . 0.0 110.634 177.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -78.54 -33.23 48.02 Favored 'General case' 0 C--N 1.312 -1.063 0 C-N-CA 119.237 -0.985 . . . . 0.0 112.064 -178.38 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -67.37 -32.83 74.02 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.176 0.512 . . . . 0.0 110.743 -176.185 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . 0.5 ' HB3' ' O ' ' A' ' 486' ' ' THR . 0.0 OUTLIER -86.59 -45.44 11.04 Favored 'General case' 0 N--CA 1.389 -3.513 0 N-CA-C 109.213 -0.662 . . . . 0.0 109.213 178.954 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 3.4 t80 -56.12 -39.38 72.14 Favored 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 113.372 0.878 . . . . 0.0 113.372 -179.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -70.52 -25.15 62.99 Favored 'General case' 0 C--N 1.305 -1.361 0 CA-C-O 121.505 0.669 . . . . 0.0 110.079 -176.621 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 23.1 m -90.01 -16.59 29.5 Favored 'General case' 0 CA--C 1.56 1.359 0 C-N-CA 123.548 0.739 . . . . 0.0 112.641 -179.923 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . 0.495 HG21 ' CE2' ' A' ' 490' ' ' TYR . 79.5 t -117.95 144.7 25.26 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 114.146 1.165 . . . . 0.0 114.146 -166.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . 0.517 ' OD2' ' HA ' ' A' ' 500' ' ' THR . 12.7 t70 71.49 -36.75 0.37 Allowed 'General case' 0 N--CA 1.498 1.947 0 N-CA-C 117.017 2.228 . . . . 0.0 117.017 167.557 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 44.3 mtpt -41.8 -67.52 0.25 Allowed 'General case' 0 C--N 1.323 -0.582 0 N-CA-C 114.918 1.451 . . . . 0.0 114.918 -166.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . 0.264 8.6 m-20 -80.92 -73.22 0.38 Allowed 'General case' 0 C--N 1.306 -1.285 0 N-CA-C 117.175 2.287 . . . . 0.0 117.175 -175.419 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.3 t-20 -101.41 -37.05 8.62 Favored 'General case' 0 C--N 1.306 -1.318 0 N-CA-C 114.913 1.449 . . . . 0.0 114.913 -172.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -76.25 11.14 1.63 Allowed 'General case' 0 CA--C 1.56 1.351 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -173.512 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . 0.517 ' HA ' ' OD2' ' A' ' 495' ' ' ASP . 25.7 m -53.68 105.74 0.15 Allowed 'General case' 0 C--O 1.249 1.059 0 C-N-CA 124.35 1.06 . . . . 0.0 113.639 -173.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 39.2 t30 -124.4 125.01 43.57 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 106.529 -1.656 . . . . 0.0 106.529 177.606 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 30.0 pt20 -59.86 -9.04 2.53 Favored 'General case' 0 N--CA 1.484 1.242 0 N-CA-C 114.536 1.31 . . . . 0.0 114.536 -171.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . 0.454 ' HB2' HD22 ' A' ' 535' ' ' LEU . 8.8 t-80 -58.97 -49.54 77.49 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.165 -1.05 . . . . 0.0 108.165 172.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 32.5 m-85 -63.95 -38.16 90.06 Favored 'General case' 0 N--CA 1.428 -1.562 0 CA-C-N 114.987 -1.006 . . . . 0.0 110.863 179.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -63.44 -50.24 70.53 Favored 'General case' 0 CA--C 1.501 -0.914 0 O-C-N 123.612 0.57 . . . . 0.0 109.63 -179.374 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.448 ' O ' HG23 ' A' ' 510' ' ' VAL . 14.7 m-85 -56.61 -46.01 81.14 Favored 'General case' 0 N--CA 1.437 -1.078 0 CA-C-N 115.715 -0.675 . . . . 0.0 112.367 -178.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . 0.535 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 21.6 t -73.84 -46.37 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.541 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.844 -178.47 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 44.0 t80 -51.72 -43.04 62.69 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-N 117.956 0.344 . . . . 0.0 111.647 176.401 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -57.09 -50.18 73.58 Favored 'General case' 0 N--CA 1.443 -0.786 0 O-C-N 123.922 0.764 . . . . 0.0 109.135 179.111 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 506' ' ' TYR . 48.6 t -61.1 -51.12 76.88 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.222 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.666 175.844 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.535 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 95.5 mt -53.04 -51.03 63.06 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.218 -0.901 . . . . 0.0 111.763 -175.301 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -71.36 -32.7 68.81 Favored 'General case' 0 CA--C 1.546 0.826 0 CA-C-N 116.53 -0.305 . . . . 0.0 110.977 -178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 18.3 t70 -66.74 -49.91 64.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 116.377 -0.374 . . . . 0.0 110.888 179.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . 0.416 ' CD2' HG12 ' A' ' 510' ' ' VAL 0.282 1.0 OUTLIER -71.3 -26.53 62.9 Favored 'General case' 0 N--CA 1.438 -1.046 0 C-N-CA 119.318 -0.953 . . . . 0.0 111.28 177.312 . . . . . . . . 4 4 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . 0.653 ' HA ' ' HB3' ' A' ' 519' ' ' ASP . 23.4 t80 -52.16 -41.17 62.37 Favored 'General case' 0 C--N 1.347 0.475 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 175.831 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -72.19 -15.06 61.95 Favored 'General case' 0 CA--C 1.555 1.153 0 CA-C-N 114.189 -1.368 . . . . 0.0 114.015 178.364 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 8.3 tp10 -120.92 -57.25 1.89 Allowed 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 -172.377 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -153.48 105.28 2.82 Favored 'General case' 0 C--N 1.297 -1.71 0 N-CA-C 103.901 -2.629 . . . . 0.0 103.901 -178.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . 0.653 ' HB3' ' HA ' ' A' ' 515' ' ' TYR . 8.0 p-10 -106.01 91.35 3.7 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 117.341 2.349 . . . . 0.0 117.341 -165.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . 0.458 ' OE1' ' HG2' ' A' ' 482' ' ' ARG . 25.2 mt-30 -145.06 158.45 43.81 Favored 'General case' 0 C--N 1.3 -1.571 0 C-N-CA 126.707 2.003 . . . . 0.0 106.389 158.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 71.8 t80 -80.52 124.49 28.99 Favored 'General case' 0 N--CA 1.424 -1.747 0 CA-C-N 119.958 1.253 . . . . 0.0 108.668 176.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 46.1 t-20 -107.68 148.31 29.55 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.46 -1.311 . . . . 0.0 107.46 179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 42.2 pt -83.14 -14.98 11.75 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.438 0 C-N-CA 122.951 0.5 . . . . 0.0 111.233 -175.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.617 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 42.4 p -57.16 -41.42 79.18 Favored 'General case' 0 N--CA 1.45 -0.436 0 CA-C-O 121.415 0.626 . . . . 0.0 109.501 176.32 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . 0.419 ' CG ' HG11 ' A' ' 510' ' ' VAL . 24.5 t70 -58.26 -49.62 76.47 Favored 'General case' 0 C--O 1.242 0.701 0 CA-C-N 114.822 -1.081 . . . . 0.0 110.17 177.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.404 ' HA ' ' HD2' ' A' ' 536' ' ' ARG . . . -59.83 -49.01 79.38 Favored 'General case' 0 N--CA 1.432 -1.343 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.256 -178.311 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.627 ' O ' HG12 ' A' ' 530' ' ' VAL . 7.8 p -65.99 -29.29 46.37 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 N-CA-C 112.273 0.471 . . . . 0.0 112.273 -179.195 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . 0.617 ' HG3' ' O ' ' A' ' 524' ' ' SER . 94.2 mt-30 -67.57 -43.5 80.44 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-O 121.751 0.786 . . . . 0.0 109.089 175.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.408 ' HB2' ' HG2' ' A' ' 536' ' ' ARG . 27.4 m-85 -78.59 4.51 13.29 Favored 'General case' 0 C--N 1.307 -1.26 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 -179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.627 HG12 ' O ' ' A' ' 527' ' ' VAL . 8.8 p -83.02 -2.4 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 119.007 -1.077 . . . . 0.0 110.977 -176.424 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -105.06 -15.23 15.15 Favored 'General case' 0 C--N 1.289 -2.048 0 CA-C-O 122.415 1.103 . . . . 0.0 108.544 177.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . 0.411 ' C ' ' H ' ' A' ' 534' ' ' GLU . 37.0 t -95.99 -143.16 0.27 Allowed 'General case' 0 C--N 1.296 -1.754 0 C-N-CA 127.574 2.35 . . . . 0.0 108.821 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . 0.49 ' O ' ' N ' ' A' ' 535' ' ' LEU . 7.8 p30 -29.97 30.05 0.0 OUTLIER 'General case' 0 N--CA 1.486 1.363 1 C-N-CA 137.252 6.221 . . . . 0.0 116.916 171.515 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . 0.424 ' C ' ' H ' ' A' ' 537' ' ' GLU . 10.0 pt-20 -30.83 10.67 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.708 1 C-N-CA 133.034 4.534 . . . . 0.0 117.962 -173.963 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.524 ' H ' HD12 ' A' ' 535' ' ' LEU . 4.3 mp -69.41 -23.92 63.78 Favored 'General case' 0 C--N 1.278 -2.514 0 N-CA-C 102.566 -3.124 . . . . 0.0 102.566 160.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.471 ' O ' HG12 ' A' ' 540' ' ' ILE . 5.6 tpp180 -68.24 -29.44 68.25 Favored 'General case' 0 N--CA 1.432 -1.353 0 CA-C-N 112.214 -2.266 . . . . 0.0 110.274 171.806 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . 0.424 ' H ' ' C ' ' A' ' 534' ' ' GLU . 2.2 tm-20 -71.77 -40.14 69.49 Favored 'General case' 0 CA--C 1.512 -0.51 0 N-CA-C 107.295 -1.372 . . . . 0.0 107.295 -178.707 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.412 ' O ' ' HB2' ' A' ' 541' ' ' SER . 24.4 m -58.69 -43.4 89.96 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 170.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . 0.433 HD11 ' HB2' ' A' ' 478' ' ' LYS . 22.6 tp -59.72 -36.5 76.68 Favored 'General case' 0 CA--C 1.56 1.348 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.762 177.327 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . 0.471 HG12 ' O ' ' A' ' 536' ' ' ARG . 35.3 mm -64.03 -37.96 81.19 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.506 0.722 . . . . 0.0 109.974 176.085 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . 0.412 ' HB2' ' O ' ' A' ' 538' ' ' THR . 21.5 m -56.81 -39.11 73.55 Favored 'General case' 0 CA--C 1.548 0.883 0 CA-C-O 121.122 0.487 . . . . 0.0 110.22 174.17 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.462 HD23 ' HA ' ' A' ' 475' ' ' ALA . 9.5 mp -66.51 -30.31 70.6 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-N 115.861 -0.609 . . . . 0.0 111.408 175.046 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 -65.04 -45.13 86.7 Favored 'General case' 0 CA--C 1.517 -0.315 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 175.812 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -75.59 45.99 0.34 Allowed 'General case' 0 C--N 1.307 -1.25 0 CA-C-N 115.282 -0.872 . . . . 0.0 111.195 174.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -50.86 136.57 22.22 Favored 'General case' 0 C--N 1.319 -0.739 0 C-N-CA 125.024 1.33 . . . . 0.0 110.084 -177.003 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . 0.424 ' C ' ' H ' ' A' ' 548' ' ' ASN . 12.2 t30 -83.75 179.67 7.53 Favored 'General case' 0 C--N 1.294 -1.84 0 CA-C-N 114.498 -1.228 . . . . 0.0 110.942 -172.335 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.492 ' C ' ' H ' ' A' ' 549' ' ' ASP . 3.1 mm? -70.01 23.63 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 126.317 1.847 . . . . 0.0 113.851 -174.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . 0.424 ' H ' ' C ' ' A' ' 546' ' ' ASN . 17.4 m120 -75.45 24.75 0.11 Allowed 'General case' 0 C--N 1.306 -1.316 0 C-N-CA 127.095 2.158 . . . . 0.0 110.208 174.563 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . 0.492 ' H ' ' C ' ' A' ' 547' ' ' LEU . 11.0 m-20 -58.88 32.72 0.01 OUTLIER 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 127.97 2.508 . . . . 0.0 117.493 -172.276 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -74.68 160.05 81.86 Favored Pre-proline 0 C--N 1.3 -1.563 0 N-CA-C 106.342 -1.725 . . . . 0.0 106.342 171.394 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 19.0 Cg_exo -37.4 130.36 0.66 Allowed 'Trans proline' 0 C--N 1.378 2.097 0 C-N-CA 123.562 2.841 . . . . 0.0 111.233 178.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . 0.412 ' HB2' ' CE1' ' A' ' 479' ' ' HIS . 31.3 p90 -73.37 -6.98 49.68 Favored 'General case' 0 CA--C 1.495 -1.155 0 N-CA-C 113.669 0.989 . . . . 0.0 113.669 -167.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 59.0 mp0 -71.36 -1.08 11.73 Favored 'General case' 0 C--N 1.291 -1.944 0 C-N-CA 124.256 1.023 . . . . 0.0 111.527 174.798 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 10.1 p30 -62.73 -21.57 65.9 Favored 'General case' 0 C--N 1.326 -0.441 0 C-N-CA 123.827 0.851 . . . . 0.0 108.887 173.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . 0.476 ' HG3' HG13 ' A' ' 556' ' ' ILE . 13.5 pt-20 -48.27 -62.96 1.22 Allowed 'General case' 0 C--O 1.215 -0.763 0 C-N-CA 124.58 1.152 . . . . 0.0 113.93 -177.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . 0.476 HG13 ' HG3' ' A' ' 555' ' ' GLU . 16.8 mt -66.39 -36.78 78.17 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.25 0 CA-C-O 120.87 0.367 . . . . 0.0 110.14 -174.089 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . 0.47 ' HA ' ' NH2' ' A' ' 579' ' ' ARG . 9.9 t70 -56.98 -52.02 66.89 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.477 -0.783 . . . . 0.0 110.787 177.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . 0.451 ' O ' HG23 ' A' ' 562' ' ' VAL . 32.8 t70 -66.94 -49.97 63.82 Favored 'General case' 0 C--N 1.316 -0.853 0 CA-C-N 115.461 -0.79 . . . . 0.0 110.278 178.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 77.4 t80 -49.75 -53.57 24.18 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 126.17 1.788 . . . . 0.0 111.655 -179.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 65.4 t -63.21 -47.93 89.97 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.726 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.625 -178.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -60.14 -41.61 93.07 Favored 'General case' 0 C--O 1.201 -1.458 0 O-C-N 123.069 0.231 . . . . 0.0 111.275 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . 0.451 HG23 ' O ' ' A' ' 558' ' ' ASP . 69.9 t -62.74 -37.3 78.73 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 CA-C-O 121.403 0.62 . . . . 0.0 111.708 -179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.458 ' HA ' ' CG ' ' A' ' 469' ' ' GLN . 54.6 mt -87.24 -39.8 13.36 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.916 0 C-N-CA 120.202 -0.599 . . . . 0.0 110.306 -173.505 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . 0.581 ' ND2' ' HA ' ' A' ' 572' ' ' GLU . 6.4 t30 -81.93 -14.98 55.34 Favored 'General case' 0 C--N 1.298 -1.656 0 CA-C-N 115.115 -0.948 . . . . 0.0 111.01 -174.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -71.95 -13.06 61.53 Favored 'General case' 0 C--N 1.355 0.845 0 C-N-CA 120.135 -0.626 . . . . 0.0 109.47 178.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . 0.535 ' HB2' ' NE2' ' A' ' 469' ' ' GLN . 63.0 tttm -60.76 -23.02 64.66 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 115.252 -0.885 . . . . 0.0 110.612 176.246 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . 0.522 ' HA3' ' HB ' ' A' ' 571' ' ' ILE . . . -89.8 1.61 81.19 Favored Glycine 0 N--CA 1.433 -1.542 0 C-N-CA 120.826 -0.702 . . . . 0.0 113.037 -179.22 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . 0.41 ' HA ' ' OE1' ' A' ' 568' ' ' GLN . 9.5 mm-40 60.07 -167.22 0.18 Allowed 'General case' 0 C--O 1.249 1.069 0 C-N-CA 124.617 1.167 . . . . 0.0 112.278 176.339 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -74.41 69.61 1.65 Allowed 'General case' 0 CA--C 1.535 0.391 0 CA-C-O 122.914 1.34 . . . . 0.0 112.862 -177.606 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 16.9 m -159.16 -62.69 0.08 Allowed 'General case' 0 C--N 1.298 -1.647 0 N-CA-C 105.333 -2.099 . . . . 0.0 105.333 175.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.522 ' HB ' ' HA3' ' A' ' 567' ' ' GLY . 55.5 mt -77.27 -40.18 29.17 Favored 'Isoleucine or valine' 0 CA--C 1.474 -1.972 0 CA-C-N 114.51 -1.223 . . . . 0.0 109.374 178.684 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . 0.581 ' HA ' ' ND2' ' A' ' 564' ' ' ASN . 18.4 tp10 -73.01 -24.62 60.77 Favored 'General case' 0 N--CA 1.392 -3.371 0 CA-C-N 114.679 -1.146 . . . . 0.0 110.245 -176.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . 0.523 ' O ' ' HG3' ' A' ' 602' ' ' LYS . 15.0 m -62.91 -44.96 94.68 Favored 'General case' 0 N--CA 1.424 -1.773 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.511 175.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 67.5 mt -54.03 -43.68 70.35 Favored 'General case' 0 C--O 1.21 -1.014 0 C-N-CA 123.878 0.871 . . . . 0.0 108.878 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . 0.484 ' HB2' ' ND2' ' A' ' 564' ' ' ASN . 65.0 t30 -59.07 -38.6 79.83 Favored 'General case' 0 C--N 1.305 -1.354 0 C-N-CA 125.759 1.624 . . . . 0.0 112.646 -179.775 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 3.5 m80 -59.93 -43.88 94.69 Favored 'General case' 0 C--O 1.255 1.392 0 CA-C-O 122.321 1.057 . . . . 0.0 108.342 178.0 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . 0.433 ' HB2' ' HE3' ' A' ' 602' ' ' LYS . 80.7 tttt -74.11 -35.09 64.14 Favored 'General case' 0 CA--C 1.544 0.73 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.909 176.346 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.434 ' HB3' ' O ' ' A' ' 575' ' ' ASN . 39.9 tp -52.04 -42.14 62.86 Favored 'General case' 0 C--N 1.305 -1.349 0 C-N-CA 123.772 0.829 . . . . 0.0 110.234 171.789 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.51 ' HG3' ' OE1' ' A' ' 595' ' ' GLN . 16.9 tpp180 -59.85 -41.48 91.52 Favored 'General case' 0 C--O 1.263 1.787 0 CA-C-O 121.705 0.764 . . . . 0.0 109.251 175.62 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . 0.428 ' HA ' ' NE2' ' A' ' 595' ' ' GLN . 38.2 tt0 -60.81 -38.92 87.04 Favored 'General case' 0 C--O 1.198 -1.607 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.846 173.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -63.79 -29.3 70.51 Favored 'General case' 0 N--CA 1.482 1.161 0 CA-C-O 121.323 0.583 . . . . 0.0 111.496 173.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.417 ' O ' ' N ' ' A' ' 584' ' ' ILE . 13.5 m -65.89 -24.3 66.82 Favored 'General case' 0 C--O 1.209 -1.044 0 C-N-CA 125.625 1.57 . . . . 0.0 111.787 179.751 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.725 ' HA ' ' CD ' ' A' ' 588' ' ' GLU . 30.9 ptt-85 -33.97 16.73 0.0 OUTLIER 'General case' 1 N--CA 1.558 4.934 0 N-CA-C 118.994 2.961 . . . . 0.0 118.994 174.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.417 ' N ' ' O ' ' A' ' 582' ' ' THR . 34.4 pt -80.0 -11.49 12.85 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.317 0 O-C-N 120.767 -1.208 . . . . 0.0 110.092 179.967 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 126.71 37.9 0.46 Allowed Glycine 0 N--CA 1.479 1.558 0 C-N-CA 118.758 -1.687 . . . . 0.0 114.286 173.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . 0.504 ' C ' ' H ' ' A' ' 588' ' ' GLU . 27.2 t70 -99.58 169.35 9.35 Favored 'General case' 0 C--N 1.263 -3.164 0 C-N-CA 126.264 1.825 . . . . 0.0 108.268 178.295 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.583 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 35.6 m -50.44 -1.44 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 CA-C-N 119.924 1.238 . . . . 0.0 111.085 168.035 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.725 ' CD ' ' HA ' ' A' ' 583' ' ' ARG . 0.0 OUTLIER -55.56 -17.04 4.67 Favored 'General case' 0 C--O 1.155 -3.881 0 C-N-CA 125.955 1.702 . . . . 0.0 110.956 167.795 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . 0.534 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 9.2 mp -66.76 -43.23 84.64 Favored 'General case' 0 C--O 1.286 2.992 0 CA-C-O 122.629 1.204 . . . . 0.0 109.373 170.357 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . 0.583 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 58.2 tp60 -56.28 -40.37 74.16 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 113.775 -1.557 . . . . 0.0 107.944 174.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.403 ' HB2' ' HA ' ' A' ' 588' ' ' GLU . 40.2 mmtm -84.29 -13.01 53.65 Favored 'General case' 0 C--O 1.189 -2.118 0 CA-C-N 114.411 -1.268 . . . . 0.0 112.408 174.74 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.534 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 43.0 t80 -60.15 -40.94 91.6 Favored 'General case' 0 CA--C 1.456 -2.653 0 C-N-CA 124.047 0.939 . . . . 0.0 109.682 -179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -54.8 -46.4 74.48 Favored 'General case' 0 C--N 1.307 -1.281 0 CA-C-N 114.802 -1.09 . . . . 0.0 109.274 173.467 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.55 ' O ' HG22 ' A' ' 598' ' ' VAL . 1.5 tt -61.16 -55.1 36.26 Favored 'General case' 0 C--O 1.207 -1.139 0 CA-C-N 115.245 -0.889 . . . . 0.0 111.195 176.418 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.531 ' HG2' ' HA ' ' A' ' 592' ' ' TYR . 6.2 pt20 -64.87 -30.11 71.09 Favored 'General case' 0 C--O 1.197 -1.704 0 C-N-CA 124.285 1.034 . . . . 0.0 111.639 -171.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . 0.474 ' O ' ' HG3' ' A' ' 600' ' ' LYS . 8.1 tt0 -63.06 -59.68 4.47 Favored 'General case' 0 N--CA 1.433 -1.295 0 N-CA-C 106.666 -1.605 . . . . 0.0 106.666 176.767 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 75.2 mt -56.94 -62.72 0.8 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 CA-C-N 113.868 -1.515 . . . . 0.0 111.51 179.79 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . 0.55 HG22 ' O ' ' A' ' 594' ' ' LEU . 18.6 m -70.21 -35.71 64.41 Favored 'Isoleucine or valine' 0 C--O 1.2 -1.551 0 N-CA-C 114.853 1.427 . . . . 0.0 114.853 -172.932 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -67.83 -31.85 71.98 Favored 'General case' 0 CA--C 1.488 -1.416 0 CA-C-N 120.018 1.281 . . . . 0.0 110.706 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . 0.576 ' O ' ' HG3' ' A' ' 604' ' ' ARG . 98.9 mttt -60.98 -49.38 77.68 Favored 'General case' 0 C--O 1.221 -0.411 0 C-N-CA 119.435 -0.906 . . . . 0.0 108.687 173.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 83.8 m-20 -64.96 -32.54 74.31 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.249 -0.887 . . . . 0.0 111.848 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.523 ' HG3' ' O ' ' A' ' 573' ' ' SER . 0.4 OUTLIER -71.93 -43.49 65.21 Favored 'General case' 0 N--CA 1.44 -0.948 0 N-CA-C 108.789 -0.819 . . . . 0.0 108.789 179.986 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . 0.428 ' C ' ' H ' ' A' ' 605' ' ' MET . 10.8 mm-40 -73.22 -15.49 61.43 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-N 116.415 -0.357 . . . . 0.0 111.669 179.293 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . 0.576 ' HG3' ' O ' ' A' ' 600' ' ' LYS . 95.9 mtt180 -73.18 36.91 0.08 Allowed 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 123.811 0.844 . . . . 0.0 111.673 175.598 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . 0.428 ' H ' ' C ' ' A' ' 603' ' ' GLU . 23.4 ptt? . . . . . 0 C--N 1.306 -1.296 0 C-N-CA 124.092 0.957 . . . . 0.0 109.235 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 . . . . . 0 N--CA 1.441 -0.875 0 CA-C-O 121.639 0.733 . . . . 0.0 112.618 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -76.27 96.92 4.05 Favored 'General case' 0 CA--C 1.491 -1.322 0 N-CA-C 107.626 -1.25 . . . . 0.0 107.626 174.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -135.11 46.87 2.38 Favored 'General case' 0 C--N 1.29 -1.999 0 CA-C-O 122.78 1.276 . . . . 0.0 108.932 179.448 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -71.57 134.75 46.66 Favored 'General case' 0 N--CA 1.412 -2.327 0 CA-C-N 113.683 -1.599 . . . . 0.0 108.657 177.757 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 13.8 m -57.04 107.37 0.4 Allowed 'General case' 0 C--N 1.289 -2.036 0 O-C-N 124.278 0.986 . . . . 0.0 113.012 -174.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 4.9 ptm85 -65.2 -22.89 66.95 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 113.064 0.765 . . . . 0.0 113.064 177.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.68 ' NE2' ' HB3' ' A' ' 566' ' ' LYS . 97.4 mt-30 -66.3 -32.15 73.38 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 109.827 -0.434 . . . . 0.0 109.827 174.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.645 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 3.2 tm-20 -71.24 -28.47 64.2 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.264 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.41 ' HA ' ' CD ' ' A' ' 474' ' ' ARG . 12.8 tmtt? -66.69 -35.42 80.1 Favored 'General case' 0 N--CA 1.45 -0.438 0 CA-C-N 115.64 -0.709 . . . . 0.0 109.513 176.286 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -62.33 -42.47 99.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 121.157 0.504 . . . . 0.0 109.72 175.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 34.6 mt-10 -66.35 -35.6 80.75 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.92 177.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.645 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 90.8 mtt180 -57.24 -43.29 82.78 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 175.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . 0.467 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -66.19 -48.36 70.93 Favored 'General case' 0 N--CA 1.44 -0.966 0 CA-C-N 115.483 -0.78 . . . . 0.0 109.477 178.026 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -62.94 -8.31 6.91 Favored 'General case' 0 C--O 1.25 1.129 0 N-CA-C 114.687 1.365 . . . . 0.0 114.687 178.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.681 ' O ' ' HG ' ' A' ' 480' ' ' LEU . 1.0 OUTLIER -55.83 -27.87 53.52 Favored 'General case' 0 C--O 1.21 -1.025 0 O-C-N 122.053 -0.404 . . . . 0.0 111.314 174.824 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.467 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 47.8 pttt -56.83 -7.96 0.53 Allowed 'General case' 0 N--CA 1.496 1.848 0 C-N-CA 124.486 1.114 . . . . 0.0 112.495 176.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.552 ' CD2' ' HA ' ' A' ' 487' ' ' PHE . 24.1 p-80 -52.95 -31.24 39.38 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.312 1.045 . . . . 0.0 110.335 177.319 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.681 ' HG ' ' O ' ' A' ' 477' ' ' LEU . 1.9 pp -71.99 5.75 2.5 Favored 'General case' 0 N--CA 1.468 0.445 0 C-N-CA 124.524 1.129 . . . . 0.0 113.221 -173.134 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 92.8 mmm -94.38 -27.57 15.99 Favored 'General case' 0 N--CA 1.42 -1.954 0 CA-C-N 116.069 -0.514 . . . . 0.0 111.014 177.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . 0.588 ' HB3' ' OG1' ' A' ' 486' ' ' THR . 40.0 ttt180 -78.18 -98.57 0.02 OUTLIER 'General case' 0 C--N 1.367 1.338 0 C-N-CA 117.79 -1.564 . . . . 0.0 109.71 179.335 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -145.35 -94.65 0.1 Allowed 'General case' 0 C--N 1.385 2.14 0 C-N-CA 113.462 -3.295 . . . . 0.0 117.752 161.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 21.6 ptmt -101.2 -43.75 5.89 Favored 'General case' 0 CA--C 1.482 -1.664 0 CA-C-O 122.718 1.247 . . . . 0.0 112.183 174.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . 0.43 ' O ' ' HB2' ' A' ' 489' ' ' ASN . 5.8 p-10 -54.16 -43.19 70.41 Favored 'General case' 0 CA--C 1.483 -1.602 0 CA-C-N 112.507 -2.133 . . . . 0.0 109.911 -175.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.588 ' OG1' ' HB3' ' A' ' 482' ' ' ARG . 2.7 m -67.4 -35.34 79.1 Favored 'General case' 0 N--CA 1.416 -2.153 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.336 -174.424 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . 0.552 ' HA ' ' CD2' ' A' ' 479' ' ' HIS . 49.1 t80 -62.59 -55.67 25.02 Favored 'General case' 0 CA--C 1.496 -1.113 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.897 178.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 2.0 tp -75.63 -22.98 56.34 Favored 'General case' 0 C--N 1.307 -1.259 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.809 -176.783 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . 0.43 ' HB2' ' O ' ' A' ' 485' ' ' ASP . 5.4 t30 -63.23 -47.01 84.27 Favored 'General case' 0 CA--C 1.5 -0.975 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 -176.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -84.33 -32.8 24.1 Favored 'General case' 0 C--N 1.311 -1.084 0 C-N-CA 119.163 -1.015 . . . . 0.0 111.53 -178.505 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -69.93 -38.02 76.09 Favored 'General case' 0 C--N 1.313 -0.986 0 C-N-CA 123.408 0.683 . . . . 0.0 112.16 -177.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -79.93 -30.16 39.88 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 120.906 0.384 . . . . 0.0 110.981 -179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 36.5 m -77.99 -40.41 39.23 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 116.649 -0.25 . . . . 0.0 111.577 -177.475 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.8 t -99.72 100.02 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.137 0 CA-C-O 121.859 0.838 . . . . 0.0 109.436 -177.473 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -87.09 21.06 2.45 Favored 'General case' 0 C--N 1.309 -1.178 0 CA-C-N 114.694 -1.139 . . . . 0.0 111.556 -176.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.453 ' NZ ' ' HB3' ' A' ' 496' ' ' LYS . 1.5 ttpm? -90.13 18.02 6.36 Favored 'General case' 0 CA--C 1.556 1.185 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 179.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -64.03 -20.44 65.92 Favored 'General case' 0 C--N 1.312 -1.049 0 C-N-CA 124.79 1.236 . . . . 0.0 113.953 -171.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 8.5 t30 -82.33 -21.49 35.99 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.32 0.581 . . . . 0.0 110.492 178.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 65.5 t80 -79.79 -25.45 40.91 Favored 'General case' 0 C--N 1.312 -1.053 0 CA-C-N 115.755 -0.657 . . . . 0.0 110.08 -179.134 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 3.3 m -67.3 140.03 57.29 Favored 'General case' 0 N--CA 1.425 -1.676 0 CA-C-N 115.536 -0.756 . . . . 0.0 110.91 -178.061 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 92.5 m-20 -68.03 175.75 2.99 Favored 'General case' 0 C--N 1.321 -0.667 0 C-N-CA 124.841 1.256 . . . . 0.0 112.54 -176.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . 0.434 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 0.0 OUTLIER -57.42 -19.69 25.22 Favored 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 124.626 1.17 . . . . 0.0 112.261 -178.211 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . 0.462 ' O ' HG23 ' A' ' 507' ' ' VAL . 17.1 t-160 -55.97 -40.01 72.64 Favored 'General case' 0 C--N 1.307 -1.246 0 C-N-CA 125.146 1.378 . . . . 0.0 109.228 177.889 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . 0.541 ' O ' ' HD1' ' A' ' 508' ' ' PHE . 55.3 t80 -57.74 -53.16 61.31 Favored 'General case' 0 C--O 1.203 -1.365 0 C-N-CA 125.572 1.549 . . . . 0.0 108.619 177.247 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.434 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 72.5 tttt -57.93 -43.3 86.18 Favored 'General case' 0 C--N 1.307 -1.277 0 C-N-CA 125.771 1.629 . . . . 0.0 111.923 -173.488 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -61.49 -56.11 23.72 Favored 'General case' 0 N--CA 1.43 -1.438 0 CA-C-N 115.782 -0.644 . . . . 0.0 111.49 179.333 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . 0.564 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 3.2 t -67.48 -46.99 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.705 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.808 -174.764 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . 0.541 ' HD1' ' O ' ' A' ' 504' ' ' PHE . 59.2 m-85 -55.3 -34.6 64.29 Favored 'General case' 0 CA--C 1.504 -0.822 0 N-CA-C 114.695 1.369 . . . . 0.0 114.695 178.181 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -60.76 -52.43 65.14 Favored 'General case' 0 C--O 1.256 1.41 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 176.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 17.9 t -63.29 -46.26 96.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.496 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.898 177.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.564 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 93.5 mt -59.76 -49.28 78.34 Favored 'General case' 0 C--O 1.206 -1.198 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.545 -176.317 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -66.36 -28.7 68.85 Favored 'General case' 0 C--N 1.319 -0.759 0 CA-C-O 120.737 0.303 . . . . 0.0 110.352 -177.394 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 38.7 t70 -70.44 -27.75 64.5 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-O 121.194 0.521 . . . . 0.0 110.249 177.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 15.2 m-85 -83.07 -42.42 17.46 Favored 'General case' 0 CA--C 1.481 -1.677 0 N-CA-C 107.834 -1.172 . . . . 0.0 107.834 175.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 77.3 t80 -50.24 -24.91 3.17 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.663 1.185 . . . . 0.0 111.349 176.779 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -52.71 -35.63 56.01 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 173.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -108.81 -61.32 1.63 Allowed 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 119.62 -0.832 . . . . 0.0 109.482 173.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 -159.14 135.71 9.3 Favored 'General case' 0 N--CA 1.483 1.188 0 N-CA-C 105.208 -2.145 . . . . 0.0 105.208 178.798 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -75.84 97.01 3.8 Favored 'General case' 0 N--CA 1.484 1.246 0 CA-C-N 120.47 1.486 . . . . 0.0 108.756 177.731 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -137.51 94.88 2.98 Favored 'General case' 0 C--N 1.293 -1.887 0 CA-C-N 115.643 -0.708 . . . . 0.0 109.43 -176.424 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . 0.568 ' CE2' ' HB2' ' A' ' 526' ' ' ALA . 0.1 OUTLIER -58.45 143.63 44.82 Favored 'General case' 0 N--CA 1.401 -2.896 0 CA-C-O 121.604 0.716 . . . . 0.0 112.101 173.715 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 40.8 t-20 -118.45 135.02 54.61 Favored 'General case' 0 C--N 1.285 -2.234 0 N-CA-C 105.14 -2.171 . . . . 0.0 105.14 173.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . 0.426 ' O ' HG12 ' A' ' 527' ' ' VAL . 3.9 tp -53.68 -34.47 24.54 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.619 0 O-C-N 123.659 0.599 . . . . 0.0 112.032 -178.91 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 28.9 t -55.36 -48.86 73.61 Favored 'General case' 0 C--N 1.308 -1.205 0 C-N-CA 122.977 0.511 . . . . 0.0 111.01 178.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.04 -42.85 99.61 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-O 121.89 0.852 . . . . 0.0 110.255 178.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.568 ' HB2' ' CE2' ' A' ' 521' ' ' TYR . . . -58.74 -52.99 63.33 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.788 179.597 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.426 HG12 ' O ' ' A' ' 523' ' ' ILE . 14.1 p -70.36 -36.23 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.421 -1.924 0 C-N-CA 123.366 0.666 . . . . 0.0 111.998 -177.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -71.67 -12.95 61.59 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 121.074 -1.016 . . . . 0.0 110.651 177.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.63 ' HB3' ' HG3' ' A' ' 536' ' ' ARG . 0.0 OUTLIER -76.52 -3.91 39.89 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 116.296 -0.411 . . . . 0.0 109.991 173.229 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . . . . . . . . . 4.7 p -72.88 22.57 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.573 1.83 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -176.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 19.1 m120 -70.41 -34.96 73.12 Favored 'General case' 0 C--N 1.318 -0.791 0 O-C-N 121.186 -0.946 . . . . 0.0 108.635 174.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 23.1 t -91.42 111.04 22.37 Favored 'General case' 0 N--CA 1.42 -1.939 0 N-CA-C 105.783 -1.932 . . . . 0.0 105.783 170.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 39.1 m-80 -61.4 -60.98 2.88 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.504 -0.771 . . . . 0.0 111.098 -174.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -56.31 -46.58 79.78 Favored 'General case' 0 C--O 1.244 0.794 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.62 -174.811 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 24.0 tp -67.59 -56.5 9.18 Favored 'General case' 0 N--CA 1.438 -1.034 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.002 -173.069 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.63 ' HG3' ' HB3' ' A' ' 529' ' ' TYR . 2.3 mmt180 -72.4 -28.24 62.86 Favored 'General case' 0 N--CA 1.419 -2.018 0 N-CA-C 114.762 1.393 . . . . 0.0 114.762 179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -57.45 -52.44 65.36 Favored 'General case' 0 C--O 1.251 1.174 0 CA-C-N 119.261 0.937 . . . . 0.0 110.002 177.677 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.428 ' O ' ' HB2' ' A' ' 541' ' ' SER . 1.9 p -63.93 -46.08 86.36 Favored 'General case' 0 N--CA 1.425 -1.689 0 C-N-CA 119.972 -0.691 . . . . 0.0 112.284 177.55 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 19.0 tp -62.82 -32.89 74.18 Favored 'General case' 0 CA--C 1.56 1.341 0 N-CA-C 112.16 0.43 . . . . 0.0 112.16 179.634 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . 0.432 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 55.9 mt -66.94 -38.42 81.35 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.786 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 173.218 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . 0.428 ' HB2' ' O ' ' A' ' 538' ' ' THR . 50.0 m -57.28 -38.54 74.08 Favored 'General case' 0 CA--C 1.564 1.485 0 CA-C-N 115.746 -0.661 . . . . 0.0 110.047 172.658 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.615 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 3.9 mm? -71.78 -27.3 62.85 Favored 'General case' 0 CA--C 1.548 0.87 0 N-CA-C 113.529 0.937 . . . . 0.0 113.529 173.352 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 -61.83 -56.09 23.11 Favored 'General case' 0 N--CA 1.48 1.025 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 174.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . 0.432 ' HG2' ' O ' ' A' ' 540' ' ' ILE . 28.1 pt20 -80.21 13.25 2.42 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 114.664 -1.153 . . . . 0.0 112.665 -179.341 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . 0.615 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 2.9 t80 -66.26 118.33 9.81 Favored 'General case' 0 C--N 1.313 -1.009 0 CA-C-O 121.655 0.741 . . . . 0.0 110.93 177.524 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -94.03 120.62 34.54 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-N 114.318 -1.31 . . . . 0.0 110.714 -175.382 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.669 ' H ' HD13 ' A' ' 547' ' ' LEU . 0.0 OUTLIER -83.15 7.15 16.89 Favored 'General case' 0 C--N 1.313 -1.011 0 N-CA-C 113.931 1.086 . . . . 0.0 113.931 -177.228 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -81.93 -21.13 37.46 Favored 'General case' 0 C--N 1.312 -1.049 0 O-C-N 121.304 -0.873 . . . . 0.0 109.799 175.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -69.31 -67.55 0.47 Allowed 'General case' 0 C--O 1.238 0.495 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 -179.432 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 1.2 pm0 -86.5 111.65 40.9 Favored Pre-proline 0 C--N 1.317 -0.838 0 N-CA-C 106.792 -1.559 . . . . 0.0 106.792 167.485 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 9.4 Cg_endo -50.1 146.61 17.13 Favored 'Trans proline' 0 C--N 1.36 1.144 0 C-N-CA 123.464 2.776 . . . . 0.0 114.579 -170.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -73.97 -2.92 26.12 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-O 122.145 0.974 . . . . 0.0 111.043 -173.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -81.97 -41.59 20.56 Favored 'General case' 0 C--N 1.295 -1.764 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.518 170.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 1.3 p-10 -73.07 -22.05 60.67 Favored 'General case' 0 C--O 1.185 -2.316 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -24.71 -70.3 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 126.629 1.972 . . . . 0.0 113.428 179.516 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 53.2 mt -68.46 -47.88 75.24 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.794 0 CA-C-N 115.46 -0.791 . . . . 0.0 109.82 -177.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 27.2 t70 -59.29 -48.89 79.92 Favored 'General case' 0 C--N 1.312 -1.049 0 CA-C-N 115.097 -0.956 . . . . 0.0 113.026 -175.59 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 22.4 t70 -66.46 -51.39 57.31 Favored 'General case' 0 C--N 1.315 -0.905 0 C-N-CA 124.084 0.953 . . . . 0.0 110.638 -177.549 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 40.6 t80 -51.58 -52.13 49.88 Favored 'General case' 0 C--O 1.246 0.872 0 C-N-CA 124.157 0.983 . . . . 0.0 110.474 176.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 95.0 t -66.91 -40.16 85.12 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.253 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.738 179.364 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -58.73 -39.4 80.77 Favored 'General case' 0 C--O 1.196 -1.757 0 C-N-CA 122.993 0.517 . . . . 0.0 110.637 178.595 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . 0.434 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 47.2 t -66.32 -36.59 77.75 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.763 0 CA-C-O 121.418 0.628 . . . . 0.0 111.873 177.169 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.547 ' HA ' ' HG2' ' A' ' 469' ' ' GLN . 49.6 mt -78.67 -43.93 25.68 Favored 'Isoleucine or valine' 0 C--N 1.289 -2.03 0 CA-C-O 121.738 0.78 . . . . 0.0 109.678 -177.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 9.2 t30 -77.94 -6.55 54.75 Favored 'General case' 0 C--N 1.289 -2.029 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.152 -179.903 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.434 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 29.2 tt0 -61.74 -45.58 93.31 Favored 'General case' 0 CA--C 1.49 -1.346 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 175.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . 0.68 ' HB3' ' NE2' ' A' ' 469' ' ' GLN . 59.4 tttm -89.94 53.25 2.48 Favored 'General case' 0 C--N 1.303 -1.449 0 CA-C-O 122.554 1.168 . . . . 0.0 108.129 178.207 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . 0.479 ' O ' HD12 ' A' ' 571' ' ' ILE . . . -102.7 -108.61 3.25 Favored Glycine 0 N--CA 1.419 -2.465 0 CA-C-N 113.941 -1.481 . . . . 0.0 110.619 178.615 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . 0.502 ' HA ' ' SD ' ' A' ' 605' ' ' MET . 8.7 tt0 78.29 170.42 0.2 Allowed 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.459 1.103 . . . . 0.0 109.324 -174.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -42.43 129.72 3.92 Favored 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.921 1.289 . . . . 0.0 111.867 -174.261 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 38.1 m 87.76 -35.64 0.03 OUTLIER 'General case' 0 C--N 1.349 0.579 0 C-N-CA 126.766 2.026 . . . . 0.0 111.148 179.875 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.479 HD12 ' O ' ' A' ' 567' ' ' GLY . 4.5 mt -89.78 -22.93 6.29 Favored 'Isoleucine or valine' 0 C--O 1.185 -2.302 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -176.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.4 -1.4 0.76 Allowed 'General case' 0 N--CA 1.418 -2.068 0 C-N-CA 125.826 1.65 . . . . 0.0 113.202 176.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 36.9 t -64.92 -20.82 66.65 Favored 'General case' 0 N--CA 1.418 -2.04 0 N-CA-C 105.503 -2.036 . . . . 0.0 105.503 168.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 97.8 mt -61.21 -21.48 63.88 Favored 'General case' 0 C--O 1.199 -1.579 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.011 170.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . 0.495 ' O ' ' HB3' ' A' ' 578' ' ' LEU . 0.9 OUTLIER -59.09 -40.75 86.26 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 172.415 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 51.1 t-80 -62.78 -50.24 71.81 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.92 -26.65 68.4 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 115.542 -0.754 . . . . 0.0 112.294 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.495 ' HB3' ' O ' ' A' ' 575' ' ' ASN . 0.8 OUTLIER -57.57 -44.22 85.14 Favored 'General case' 0 C--O 1.256 1.439 0 C-N-CA 123.903 0.881 . . . . 0.0 109.898 172.362 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.466 ' HA ' ' CD ' ' A' ' 591' ' ' LYS . 40.5 ttp180 -63.87 -43.01 97.35 Favored 'General case' 0 N--CA 1.438 -1.044 0 CA-C-N 115.612 -0.722 . . . . 0.0 112.014 174.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -52.91 -52.41 57.81 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 123.656 0.598 . . . . 0.0 111.579 175.15 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -57.47 -38.29 74.29 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.569 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.46 ' C ' ' H ' ' A' ' 584' ' ' ILE . 3.6 m -71.38 -23.63 61.92 Favored 'General case' 0 N--CA 1.477 0.878 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 177.067 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . . . . . . . . . 82.1 mtp180 -51.44 -1.21 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.037 0 N-CA-C 113.312 0.856 . . . . 0.0 113.312 173.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.46 ' H ' ' C ' ' A' ' 582' ' ' THR . 13.9 tt -74.85 31.9 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.58 2.119 0 C-N-CA 125.667 1.587 . . . . 0.0 111.269 -179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 130.58 -25.86 4.17 Favored Glycine 0 C--N 1.296 -1.667 0 N-CA-C 117.538 1.775 . . . . 0.0 117.538 168.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . 0.545 ' O ' ' HB2' ' A' ' 590' ' ' GLN . 23.2 t70 -138.11 89.22 2.38 Favored 'General case' 0 CA--C 1.488 -1.415 0 CA-C-N 120.331 2.066 . . . . 0.0 111.808 176.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.488 ' O ' ' HB3' ' A' ' 591' ' ' LYS . 35.2 m -71.55 -41.84 72.15 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.384 0 CA-C-N 114.41 -1.268 . . . . 0.0 112.912 178.076 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -67.02 -70.88 0.22 Allowed 'General case' 0 N--CA 1.438 -1.055 0 N-CA-C 112.934 0.716 . . . . 0.0 112.934 -168.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 36.5 tp -76.03 -50.48 14.67 Favored 'General case' 0 C--N 1.299 -1.614 0 C-N-CA 120.726 -0.39 . . . . 0.0 111.839 -172.474 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . 0.545 ' HB2' ' O ' ' A' ' 586' ' ' ASP . 32.3 mm-40 -55.47 -50.31 70.21 Favored 'General case' 0 CA--C 1.494 -1.178 0 CA-C-N 116.029 -0.532 . . . . 0.0 111.475 178.585 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.667 ' HA ' ' HE3' ' A' ' 591' ' ' LYS 0.269 1.6 tpmt? -81.2 -32.89 33.29 Favored 'General case' 0 N--CA 1.4 -2.926 0 C-N-CA 117.572 -1.651 . . . . 0.0 113.449 -173.297 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -53.79 -52.03 61.56 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 119.103 0.865 . . . . 0.0 110.075 177.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . 0.45 ' O ' HG13 ' A' ' 597' ' ' ILE . 56.4 t80 -59.74 -59.13 5.92 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.359 179.35 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.4 HD13 ' O ' ' A' ' 590' ' ' GLN . 7.3 mp -59.65 -45.64 91.4 Favored 'General case' 0 CA--C 1.546 0.806 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -177.461 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.439 ' HA ' HG12 ' A' ' 598' ' ' VAL . 0.0 OUTLIER -69.69 -34.75 74.38 Favored 'General case' 0 C--O 1.215 -0.745 0 O-C-N 122.193 -0.317 . . . . 0.0 111.547 -175.18 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -63.53 -44.39 94.35 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 179.142 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.45 HG13 ' O ' ' A' ' 593' ' ' TYR . 77.3 mt -55.03 -56.78 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.139 0 CA-C-N 114.966 -1.015 . . . . 0.0 111.114 177.374 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . 0.439 HG12 ' HA ' ' A' ' 595' ' ' GLN . 7.3 p -67.06 -36.09 76.16 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.715 0 N-CA-C 112.338 0.496 . . . . 0.0 112.338 -176.946 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -62.69 -44.51 96.06 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-O 121.928 0.871 . . . . 0.0 110.15 178.553 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -69.59 -33.76 73.16 Favored 'General case' 0 N--CA 1.431 -1.391 0 CA-C-N 115.753 -0.658 . . . . 0.0 109.608 177.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 61.1 t30 -66.49 -38.41 87.21 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.263 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -69.75 -39.39 76.76 Favored 'General case' 0 C--N 1.321 -0.641 0 C-N-CA 119.838 -0.745 . . . . 0.0 111.911 178.881 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -70.86 -25.33 62.77 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 119.514 -0.874 . . . . 0.0 110.323 177.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 52.8 ttt180 -68.56 -26.19 65.28 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 115.169 -0.923 . . . . 0.0 109.681 175.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . 0.502 ' SD ' ' HA ' ' A' ' 568' ' ' GLN . 43.9 ttm . . . . . 0 C--O 1.245 0.855 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 -178.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 37.8 p90 . . . . . 0 N--CA 1.434 -1.229 0 N-CA-C 113.055 0.761 . . . . 0.0 113.055 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -91.0 107.15 19.01 Favored 'General case' 0 C--N 1.299 -1.605 0 CA-C-N 115.181 -0.918 . . . . 0.0 108.567 174.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 66.7 t30 -124.02 46.54 2.24 Favored 'General case' 0 C--N 1.288 -2.072 0 C-N-CA 119.246 -0.982 . . . . 0.0 109.057 178.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 98.9 mt -75.97 89.01 2.95 Favored 'General case' 0 N--CA 1.437 -1.09 0 N-CA-C 106.973 -1.491 . . . . 0.0 106.973 168.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 17.0 m -58.9 136.72 57.95 Favored 'General case' 0 C--N 1.285 -2.211 0 CA-C-N 114.021 -1.445 . . . . 0.0 114.298 -171.113 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 35.6 ttt180 -65.83 -32.78 74.5 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.404 -0.817 . . . . 0.0 110.911 176.36 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.487 ' HG2' ' HA ' ' A' ' 563' ' ' ILE . 97.3 mt-30 -64.28 -41.85 96.69 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 109.532 -0.544 . . . . 0.0 109.532 175.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.514 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 5.8 tm-20 -63.34 -29.05 70.42 Favored 'General case' 0 CA--C 1.55 0.949 0 CA-C-N 115.58 -0.736 . . . . 0.0 109.287 178.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.414 ' HD3' ' HA ' ' A' ' 471' ' ' LYS . 25.9 mmtm -66.34 -37.86 86.32 Favored 'General case' 0 CA--C 1.514 -0.427 0 CA-C-N 116.358 -0.383 . . . . 0.0 111.555 171.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.44 -36.96 71.44 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 116.399 -0.364 . . . . 0.0 110.118 -177.998 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . 0.444 ' HB3' ' CZ ' ' A' ' 504' ' ' PHE . 0.9 OUTLIER -57.94 -40.81 81.4 Favored 'General case' 0 CA--C 1.539 0.555 0 O-C-N 123.327 0.392 . . . . 0.0 110.777 171.863 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 93.4 mtt180 -62.37 -42.81 99.7 Favored 'General case' 0 N--CA 1.476 0.834 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 177.285 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -67.44 -29.88 69.47 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.312 -0.858 . . . . 0.0 111.058 179.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -66.03 -33.58 76.12 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-O 121.68 0.752 . . . . 0.0 109.875 177.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 87.3 mt -76.52 10.57 2.03 Favored 'General case' 0 C--O 1.214 -0.785 0 CA-C-N 115.239 -0.891 . . . . 0.0 112.446 177.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.437 ' HE3' ' CD2' ' A' ' 545' ' ' TYR . 18.9 tptm -59.88 -10.62 4.18 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.433 1.093 . . . . 0.0 112.989 -178.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 86.4 m-70 -74.76 142.03 44.35 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.908 -0.495 . . . . 0.0 111.424 -176.144 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.733 ' H ' HD13 ' A' ' 480' ' ' LEU . 0.0 OUTLIER -75.66 -150.77 0.03 OUTLIER 'General case' 0 C--O 1.202 -1.428 0 CA-C-N 115.394 -0.821 . . . . 0.0 109.792 175.252 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . 0.465 ' C ' ' H ' ' A' ' 483' ' ' ASP . 66.8 mtt -50.4 -9.88 0.05 Allowed 'General case' 0 N--CA 1.516 2.851 0 N-CA-C 115.284 1.587 . . . . 0.0 115.284 -177.411 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 3.5 tpt180 -72.92 7.12 2.18 Favored 'General case' 0 CA--C 1.561 1.386 0 C-N-CA 125.185 1.394 . . . . 0.0 109.518 172.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . 0.465 ' H ' ' C ' ' A' ' 481' ' ' MET . 5.5 p-10 -70.41 -10.96 60.52 Favored 'General case' 0 C--N 1.311 -1.08 0 C-N-CA 125.701 1.6 . . . . 0.0 113.65 -170.178 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 21.3 pttp -63.02 -44.63 95.44 Favored 'General case' 0 C--N 1.311 -1.093 0 CA-C-O 121.738 0.78 . . . . 0.0 109.649 176.086 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -62.61 -51.67 66.38 Favored 'General case' 0 CA--C 1.504 -0.811 0 CA-C-N 114.726 -1.124 . . . . 0.0 109.649 178.428 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 59.0 m -61.81 -40.64 95.95 Favored 'General case' 0 N--CA 1.44 -0.947 0 CA-C-N 114.561 -1.199 . . . . 0.0 111.995 -178.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . 0.549 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 23.1 t80 -56.57 -53.28 59.4 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 122.394 0.278 . . . . 0.0 110.734 179.558 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.437 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 65.8 mt -72.73 -25.46 61.22 Favored 'General case' 0 C--N 1.318 -0.77 0 C-N-CA 119.759 -0.776 . . . . 0.0 111.588 -178.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 60.6 t30 -69.23 -39.85 78.28 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.636 0.731 . . . . 0.0 110.085 -179.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -86.79 -21.48 26.47 Favored 'General case' 0 N--CA 1.424 -1.737 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.326 -179.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . 0.549 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.3 OUTLIER -67.03 -41.24 86.94 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 123.801 0.84 . . . . 0.0 109.332 178.878 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . 0.437 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 8.9 pt-20 -77.92 -46.32 21.6 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 113.633 0.975 . . . . 0.0 113.633 -176.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 27.5 p -89.98 -28.65 18.98 Favored 'General case' 0 C--N 1.312 -1.036 0 N-CA-C 115.572 1.693 . . . . 0.0 115.572 -170.435 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 47.0 t -91.2 162.7 2.39 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 O-C-N 122.012 -0.43 . . . . 0.0 111.187 -170.297 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 4.2 t70 -75.09 109.82 8.88 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-O 121.896 0.855 . . . . 0.0 111.05 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 9.3 mtmp? -88.9 -25.02 22.34 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 114.143 -1.389 . . . . 0.0 108.715 176.752 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 10.1 m-20 -86.75 -66.57 0.89 Allowed 'General case' 0 C--N 1.3 -1.582 0 N-CA-C 118.845 2.906 . . . . 0.0 118.845 -166.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 15.1 m120 -107.27 -34.15 7.19 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 118.723 2.86 . . . . 0.0 118.723 -160.223 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 40.0 t80 -76.77 -94.97 0.02 OUTLIER 'General case' 0 CA--C 1.566 1.574 0 N-CA-C 115.929 1.825 . . . . 0.0 115.929 -163.725 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 19.6 m -129.84 76.08 1.7 Allowed 'General case' 0 C--N 1.314 -0.977 0 O-C-N 120.794 -1.191 . . . . 0.0 109.303 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 27.8 p30 -130.79 45.87 2.75 Favored 'General case' 0 C--N 1.293 -1.879 0 N-CA-C 117.397 2.369 . . . . 0.0 117.397 -170.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 47.9 tt0 -84.85 -33.65 22.8 Favored 'General case' 0 CA--C 1.492 -1.278 0 N-CA-C 107.287 -1.375 . . . . 0.0 107.287 170.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . 0.561 ' CD2' HD11 ' A' ' 535' ' ' LEU . 45.4 m170 -59.25 -51.68 68.94 Favored 'General case' 0 CA--C 1.506 -0.728 0 N-CA-C 106.906 -1.516 . . . . 0.0 106.906 177.94 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . 0.444 ' CZ ' ' HB3' ' A' ' 473' ' ' GLU . 97.0 m-85 -68.01 -25.76 65.55 Favored 'General case' 0 C--N 1.306 -1.319 0 CA-C-N 113.973 -1.467 . . . . 0.0 114.308 178.37 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -63.83 -46.83 83.32 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 106.84 -1.541 . . . . 0.0 106.84 175.522 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.583 ' O ' HG23 ' A' ' 510' ' ' VAL . 2.6 t80 -64.37 -32.56 74.23 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 114.893 -1.049 . . . . 0.0 112.379 174.892 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 87.7 t -65.53 -50.4 72.31 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 N-CA-C 109.967 -0.383 . . . . 0.0 109.967 173.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 55.5 m-85 -51.98 -43.01 63.38 Favored 'General case' 0 C--N 1.355 0.845 0 CA-C-O 120.899 0.38 . . . . 0.0 110.126 173.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 5.7 tp10 -55.98 -60.11 3.95 Favored 'General case' 0 N--CA 1.443 -0.812 0 CA-C-N 114.921 -1.036 . . . . 0.0 110.341 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.583 HG23 ' O ' ' A' ' 506' ' ' TYR . 21.5 t -58.07 -53.58 43.72 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 O-C-N 123.57 0.544 . . . . 0.0 110.873 -179.885 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 94.8 mt -65.58 -36.94 85.25 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 -174.007 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 59.9 t60 -70.06 -32.2 70.18 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 120.485 -0.486 . . . . 0.0 109.808 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -72.43 -27.69 62.49 Favored 'General case' 0 N--CA 1.468 0.468 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 178.22 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 7.7 m-85 -67.04 -54.24 23.49 Favored 'General case' 0 CA--C 1.49 -1.329 0 CA-C-N 115.704 -0.68 . . . . 0.0 109.907 171.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . 0.436 ' HA ' ' HB3' ' A' ' 519' ' ' ASP . 0.4 OUTLIER -49.96 -29.68 8.95 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.801 0.84 . . . . 0.0 112.552 178.333 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -63.77 -36.23 83.21 Favored 'General case' 0 C--N 1.313 -0.993 0 CA-C-N 115.688 -0.687 . . . . 0.0 111.572 177.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 34.7 mm-40 -111.89 -59.41 1.99 Allowed 'General case' 0 C--N 1.323 -0.546 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.4 -176.116 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -157.31 118.81 3.69 Favored 'General case' 0 CA--C 1.493 -1.224 0 C-N-CA 125.148 1.379 . . . . 0.0 107.659 -179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . 0.436 ' HB3' ' HA ' ' A' ' 515' ' ' TYR . 2.2 p-10 -90.95 92.51 8.79 Favored 'General case' 0 C--N 1.297 -1.712 0 N-CA-C 113.703 1.001 . . . . 0.0 113.703 -175.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 88.5 mt-30 -144.4 128.93 18.05 Favored 'General case' 0 C--N 1.31 -1.14 0 C-N-CA 126.49 1.916 . . . . 0.0 107.055 162.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 81.9 t80 -70.32 132.42 45.65 Favored 'General case' 0 N--CA 1.425 -1.715 0 CA-C-N 119.546 1.066 . . . . 0.0 110.453 177.405 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 13.2 m120 -118.73 135.0 54.73 Favored 'General case' 0 C--N 1.3 -1.579 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 177.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 34.5 pt -79.47 -16.21 13.2 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.991 0 CA-C-O 122.152 0.977 . . . . 0.0 110.216 -175.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.402 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 5.6 p -60.05 -30.9 69.5 Favored 'General case' 0 N--CA 1.429 -1.519 0 CA-C-N 114.974 -1.012 . . . . 0.0 109.258 172.318 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -65.73 -39.64 91.34 Favored 'General case' 0 CA--C 1.481 -1.675 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.771 178.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -62.72 -42.3 99.59 Favored 'General case' 0 C--N 1.323 -0.55 0 C-N-CA 119.325 -0.95 . . . . 0.0 109.34 175.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.432 ' O ' HG12 ' A' ' 530' ' ' VAL . 61.5 t -61.8 -35.92 70.65 Favored 'Isoleucine or valine' 0 CA--C 1.561 1.375 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.966 175.416 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . 0.402 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.5 mm100 -72.24 -24.24 61.34 Favored 'General case' 0 C--N 1.314 -0.973 0 O-C-N 121.498 -0.751 . . . . 0.0 111.332 176.517 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.409 ' CE2' HG22 ' A' ' 510' ' ' VAL . 9.2 m-85 -79.64 -23.08 42.82 Favored 'General case' 0 N--CA 1.44 -0.97 0 N-CA-C 112.689 0.626 . . . . 0.0 112.689 175.788 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.432 HG12 ' O ' ' A' ' 527' ' ' VAL 0.369 12.2 p -75.93 55.56 0.07 OUTLIER 'Isoleucine or valine' 0 C--O 1.241 0.606 0 CA-C-O 123.062 1.41 . . . . 0.0 114.034 -177.99 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -105.0 -29.95 10.1 Favored 'General case' 0 C--N 1.296 -1.756 0 N-CA-C 104.209 -2.515 . . . . 0.0 104.209 172.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 46.5 m -92.92 161.9 14.29 Favored 'General case' 0 N--CA 1.443 -0.805 0 N-CA-C 106.142 -1.799 . . . . 0.0 106.142 164.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 -86.29 -58.43 2.63 Favored 'General case' 0 C--N 1.289 -2.041 0 N-CA-C 114.598 1.333 . . . . 0.0 114.598 -176.143 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.17 -79.64 0.02 OUTLIER 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 116.246 1.943 . . . . 0.0 116.246 -161.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.561 HD11 ' CD2' ' A' ' 503' ' ' HIS . 2.6 mm? -75.44 -17.27 60.2 Favored 'General case' 0 C--N 1.303 -1.414 0 CA-C-O 122.109 0.956 . . . . 0.0 112.132 -172.252 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 4.5 mmt180 -77.84 -46.0 22.72 Favored 'General case' 0 C--N 1.272 -2.799 0 CA-C-N 113.775 -1.557 . . . . 0.0 107.523 -173.604 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -66.5 -38.32 86.98 Favored 'General case' 0 N--CA 1.442 -0.826 0 CA-C-N 115.021 -0.991 . . . . 0.0 109.086 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 32.1 m -57.07 -51.61 68.6 Favored 'General case' 0 N--CA 1.447 -0.585 0 CA-C-N 115.932 -0.576 . . . . 0.0 110.709 178.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 27.9 tp -57.7 -45.55 85.52 Favored 'General case' 0 CA--C 1.545 0.781 0 N-CA-C 111.323 0.12 . . . . 0.0 111.323 -178.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 78.9 mt -60.18 -37.79 74.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 CA-C-O 121.424 0.631 . . . . 0.0 110.289 176.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.7 m -57.27 -35.41 69.73 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-N 115.75 -0.659 . . . . 0.0 111.474 176.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 7.6 mp -70.31 -43.89 69.41 Favored 'General case' 0 CA--C 1.545 0.777 0 CA-C-O 120.903 0.382 . . . . 0.0 110.218 174.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -60.9 -36.43 79.23 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 124.09 0.956 . . . . 0.0 113.084 -177.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 17.8 pt20 -72.48 23.81 0.06 Allowed 'General case' 0 CA--C 1.553 1.078 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 179.556 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . 0.437 ' CD2' ' HE3' ' A' ' 478' ' ' LYS . 50.7 t80 -65.92 147.16 53.8 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 177.137 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -87.59 173.67 8.91 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -173.199 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.412 ' C ' ' H ' ' A' ' 549' ' ' ASP . 7.7 mp -80.53 21.42 0.64 Allowed 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -174.234 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 23.2 p-10 -77.02 22.78 0.19 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.197 0.599 . . . . 0.0 111.98 178.309 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . 0.412 ' H ' ' C ' ' A' ' 547' ' ' LEU . 23.0 m-20 -63.67 3.84 0.32 Allowed 'General case' 0 N--CA 1.493 1.687 0 C-N-CA 127.148 2.179 . . . . 0.0 115.181 -175.365 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.475 ' HB3' ' HD2' ' A' ' 551' ' ' PRO . 47.0 mt-10 -60.26 151.57 67.19 Favored Pre-proline 0 C--N 1.308 -1.199 0 CA-C-O 118.789 -0.624 . . . . 0.0 109.74 179.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . 0.475 ' HD2' ' HB3' ' A' ' 550' ' ' GLU . 1.9 Cg_exo 8.99 74.71 0.0 OUTLIER 'Trans proline' 0 C--N 1.379 2.179 1 C-N-CA 126.534 4.823 . . . . 0.0 117.032 -164.339 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 56.0 p90 -84.56 5.0 29.46 Favored 'General case' 0 CA--C 1.506 -0.736 0 CA-C-N 113.958 -1.474 . . . . 0.0 111.574 -178.065 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -73.5 10.4 1.06 Allowed 'General case' 0 C--N 1.288 -2.102 0 N-CA-C 114.018 1.118 . . . . 0.0 114.018 -176.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . 0.497 ' HA ' ' HG3' ' A' ' 583' ' ' ARG . 24.1 p-10 -76.04 -21.66 56.56 Favored 'General case' 0 N--CA 1.426 -1.643 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 168.458 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 60.4 tt0 -25.41 -75.38 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 127.322 2.249 . . . . 0.0 113.348 178.643 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 22.4 pt -61.99 -35.73 70.04 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 C-N-CA 123.85 0.86 . . . . 0.0 112.432 -177.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 12.8 t70 -61.34 -54.11 47.96 Favored 'General case' 0 N--CA 1.483 1.199 0 N-CA-C 108.587 -0.894 . . . . 0.0 108.587 178.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . 0.714 ' HA ' ' CE1' ' A' ' 576' ' ' HIS . 28.7 t70 -63.43 -46.34 86.76 Favored 'General case' 0 C--O 1.201 -1.496 0 CA-C-N 113.897 -1.501 . . . . 0.0 110.909 -179.448 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . 0.597 ' O ' HG12 ' A' ' 563' ' ' ILE . 75.5 t80 -57.77 -53.3 59.72 Favored 'General case' 0 C--N 1.291 -1.94 0 C-N-CA 123.798 0.839 . . . . 0.0 112.009 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 71.6 t -63.55 -46.63 94.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.478 0 N-CA-C 110.304 -0.258 . . . . 0.0 110.304 -179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.445 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 64.4 m-20 -60.32 -47.7 84.9 Favored 'General case' 0 C--O 1.175 -2.842 0 CA-C-O 118.151 -0.928 . . . . 0.0 112.149 177.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . 0.49 ' HA ' ' HG2' ' A' ' 565' ' ' GLU . 55.6 t -60.38 -47.87 90.66 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.991 0 CA-C-N 119.271 0.941 . . . . 0.0 111.289 -179.423 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.597 HG12 ' O ' ' A' ' 559' ' ' TYR . 38.5 mm -66.03 -32.41 58.02 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.252 0 CA-C-O 121.543 0.687 . . . . 0.0 110.321 -176.334 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -92.29 -22.76 19.56 Favored 'General case' 0 C--N 1.3 -1.571 0 N-CA-C 112.739 0.644 . . . . 0.0 112.739 -175.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.49 ' HG2' ' HA ' ' A' ' 562' ' ' VAL . 6.9 pt-20 -85.24 -28.69 25.2 Favored 'General case' 0 CA--C 1.505 -0.76 0 C-N-CA 119.473 -0.891 . . . . 0.0 109.039 -175.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . 0.474 ' HA ' ' HE3' ' A' ' 566' ' ' LYS . 0.0 OUTLIER -80.32 14.67 1.87 Allowed 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.942 -175.78 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -71.92 -45.26 43.31 Favored Glycine 0 N--CA 1.441 -1.025 0 N-CA-C 109.686 -1.366 . . . . 0.0 109.686 174.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 6.5 pm0 -136.98 -2.17 2.11 Favored 'General case' 0 C--N 1.311 -1.097 0 C-N-CA 122.782 0.433 . . . . 0.0 110.724 176.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 66.6 101.92 0.04 OUTLIER 'General case' 0 C--O 1.236 0.389 0 C-N-CA 125.507 1.523 . . . . 0.0 109.384 -176.414 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . 0.536 ' HB ' ' OE1' ' A' ' 572' ' ' GLU . 19.6 p -93.4 -173.88 3.34 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 116.11 1.893 . . . . 0.0 116.11 -167.108 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 2.0 mt -89.64 -31.62 5.38 Favored 'Isoleucine or valine' 0 N--CA 1.438 -1.065 0 N-CA-C 104.114 -2.55 . . . . 0.0 104.114 173.91 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . 0.536 ' OE1' ' HB ' ' A' ' 570' ' ' THR . 3.2 mp0 -59.23 -19.1 42.83 Favored 'General case' 0 C--O 1.197 -1.709 0 CA-C-N 112.868 -1.969 . . . . 0.0 110.715 177.025 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 50.3 m -59.56 -41.53 90.34 Favored 'General case' 0 N--CA 1.427 -1.606 0 C-N-CA 123.483 0.713 . . . . 0.0 109.414 174.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 6.4 mp -70.25 -45.55 66.23 Favored 'General case' 0 C--O 1.256 1.444 0 CA-C-O 121.828 0.823 . . . . 0.0 110.182 177.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -59.9 -35.25 74.45 Favored 'General case' 0 C--O 1.213 -0.836 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.052 176.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . 0.714 ' CE1' ' HA ' ' A' ' 558' ' ' ASP . 15.0 t60 -59.61 -41.29 90.03 Favored 'General case' 0 C--O 1.202 -1.435 0 C-N-CA 123.015 0.526 . . . . 0.0 111.184 175.177 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 38.9 ttmt -53.28 -54.85 30.24 Favored 'General case' 0 C--O 1.245 0.863 0 N-CA-C 108.908 -0.775 . . . . 0.0 108.908 177.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.447 HD12 ' HG2' ' A' ' 595' ' ' GLN . 69.3 mt -64.35 -39.53 94.07 Favored 'General case' 0 CA--C 1.57 1.741 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.818 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.777 ' O ' ' HB ' ' A' ' 582' ' ' THR . 36.1 ttt180 -64.3 -32.03 73.47 Favored 'General case' 0 C--O 1.264 1.84 0 C-N-CA 124.383 1.073 . . . . 0.0 113.433 176.61 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 36.0 tt0 -67.63 -41.69 83.52 Favored 'General case' 0 C--N 1.298 -1.672 0 N-CA-C 107.848 -1.167 . . . . 0.0 107.848 179.106 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . 0.496 ' O ' HD13 ' A' ' 589' ' ' LEU . . . -62.75 -30.55 71.52 Favored 'General case' 0 N--CA 1.445 -0.688 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.445 172.609 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.777 ' HB ' ' O ' ' A' ' 579' ' ' ARG . 23.2 m -60.46 -42.83 96.99 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.892 0.877 . . . . 0.0 112.822 -178.498 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.497 ' HG3' ' HA ' ' A' ' 554' ' ' ASN 0.34 20.8 mmm180 -39.75 -31.61 0.11 Allowed 'General case' 0 N--CA 1.499 2.009 0 N-CA-C 120.789 3.625 . . . . 0.0 120.789 -171.868 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 7.2 tp -80.32 -30.1 12.49 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.346 0 CA-C-N 120.659 1.572 . . . . 0.0 111.573 178.046 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 90.03 49.47 3.31 Favored Glycine 0 C--N 1.309 -0.94 0 N-CA-C 116.142 1.217 . . . . 0.0 116.142 174.372 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -85.15 162.41 19.25 Favored 'General case' 0 N--CA 1.482 1.135 0 N-CA-C 108.329 -0.989 . . . . 0.0 108.329 172.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 34.4 m -59.18 -39.3 78.31 Favored 'Isoleucine or valine' 0 C--O 1.264 1.833 0 CA-C-N 118.691 0.678 . . . . 0.0 112.239 179.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.503 ' O ' ' HD1' ' A' ' 592' ' ' TYR . 41.1 mm-40 -67.11 -34.89 78.59 Favored 'General case' 0 CA--C 1.476 -1.89 0 O-C-N 121.312 -0.868 . . . . 0.0 109.235 176.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . 0.496 HD13 ' O ' ' A' ' 581' ' ' ALA . 79.8 mt -73.73 -17.32 61.13 Favored 'General case' 0 N--CA 1.416 -2.164 0 CA-C-N 114.742 -1.117 . . . . 0.0 110.691 179.798 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . 0.419 ' O ' ' HB3' ' A' ' 593' ' ' TYR . 51.5 tt0 -64.95 -38.59 91.48 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 108.664 -0.865 . . . . 0.0 108.664 167.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.763 ' O ' ' HB3' ' A' ' 594' ' ' LEU . 89.8 mttt -63.13 -34.14 76.96 Favored 'General case' 0 N--CA 1.488 1.465 0 CA-C-O 123.066 1.413 . . . . 0.0 109.237 172.014 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.544 ' O ' ' HB2' ' A' ' 595' ' ' GLN . 10.9 m-85 -64.26 -39.78 94.63 Favored 'General case' 0 CA--C 1.589 2.467 0 CA-C-O 122.493 1.14 . . . . 0.0 109.612 171.35 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . 0.745 ' HA ' ' NE2' ' A' ' 596' ' ' GLN . 71.5 t80 -58.55 -29.32 66.27 Favored 'General case' 0 CA--C 1.559 1.3 0 O-C-N 121.602 -0.686 . . . . 0.0 110.666 171.038 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.763 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 11.6 tp -58.77 -39.09 79.98 Favored 'General case' 0 C--O 1.211 -0.954 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 170.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.544 ' HB2' ' O ' ' A' ' 592' ' ' TYR . 0.5 OUTLIER -55.04 -36.54 65.64 Favored 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 121.029 -0.269 . . . . 0.0 111.182 173.466 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . 0.745 ' NE2' ' HA ' ' A' ' 593' ' ' TYR . 1.7 mp0 -60.96 -47.72 85.12 Favored 'General case' 0 N--CA 1.487 1.387 0 C-N-CA 119.352 -0.939 . . . . 0.0 110.69 172.56 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 1.8 mp -57.28 -39.24 66.46 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.98 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.84 174.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 594' ' ' LEU . 87.9 t -65.3 -40.64 89.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.499 0 C-N-CA 123.304 0.642 . . . . 0.0 111.059 177.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.516 ' O ' ' HG3' ' A' ' 602' ' ' LYS . . . -61.98 -43.88 97.92 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.076 -0.712 . . . . 0.0 109.076 177.349 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 49.1 tttm -63.89 -39.82 95.06 Favored 'General case' 0 C--N 1.306 -1.309 0 CA-C-N 114.834 -1.075 . . . . 0.0 110.049 175.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . 0.592 ' O ' ' HB3' ' A' ' 604' ' ' ARG . 9.0 t30 -64.74 -36.39 84.13 Favored 'General case' 0 C--N 1.315 -0.895 0 C-N-CA 123.403 0.681 . . . . 0.0 111.341 179.489 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.516 ' HG3' ' O ' ' A' ' 599' ' ' ALA . 0.0 OUTLIER -73.64 -30.97 63.26 Favored 'General case' 0 C--N 1.314 -0.966 0 C-N-CA 119.898 -0.721 . . . . 0.0 110.235 178.406 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -73.64 -19.4 60.86 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.926 0.87 . . . . 0.0 110.439 176.156 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . 0.592 ' HB3' ' O ' ' A' ' 601' ' ' ASN . 65.5 ttt180 -70.88 -13.17 61.93 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 124.614 1.166 . . . . 0.0 109.687 174.537 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 80.4 mmm . . . . . 0 C--O 1.251 1.147 0 C-N-CA 125.798 1.639 . . . . 0.0 110.527 -179.625 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.412 -2.335 0 N-CA-C 108.264 -1.013 . . . . 0.0 108.264 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 2.5 p-10 -85.18 -173.27 4.61 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-O 121.0 0.428 . . . . 0.0 111.088 -175.119 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -96.7 74.29 2.72 Favored 'General case' 0 N--CA 1.423 -1.808 0 CA-C-O 122.356 1.074 . . . . 0.0 110.248 -176.741 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 73.9 mt -58.07 119.82 7.48 Favored 'General case' 0 C--N 1.287 -2.11 0 CA-C-N 113.486 -1.688 . . . . 0.0 107.802 174.54 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 49.6 m -98.67 105.63 17.8 Favored 'General case' 0 C--N 1.291 -1.971 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -167.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -68.09 -40.13 82.72 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 114.504 -1.225 . . . . 0.0 107.95 171.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 15.6 mt-30 -59.0 -32.14 69.42 Favored 'General case' 0 N--CA 1.438 -1.059 0 CA-C-N 113.517 -1.674 . . . . 0.0 110.856 -178.677 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.607 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 38.0 tt0 -67.16 -34.97 78.69 Favored 'General case' 0 C--O 1.217 -0.61 0 C-N-CA 120.392 -0.523 . . . . 0.0 110.211 178.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.494 ' O ' ' HD3' ' A' ' 471' ' ' LYS . 2.2 tmtp? -66.66 -41.6 87.95 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -178.012 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . 0.437 ' HB3' HD11 ' A' ' 563' ' ' ILE . . . -60.06 -41.29 92.05 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-N 115.982 -0.554 . . . . 0.0 109.987 177.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . 0.53 ' HB3' ' CZ ' ' A' ' 504' ' ' PHE . 0.3 OUTLIER -66.21 -39.41 89.61 Favored 'General case' 0 C--N 1.32 -0.711 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.386 179.629 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.607 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 98.2 mtt180 -55.08 -45.08 75.37 Favored 'General case' 0 N--CA 1.474 0.754 0 CA-C-O 121.152 0.501 . . . . 0.0 109.83 177.174 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -68.14 -42.55 79.94 Favored 'General case' 0 C--O 1.246 0.905 0 CA-C-N 115.499 -0.773 . . . . 0.0 111.03 -179.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 3.8 t80 -63.02 -52.81 61.45 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.799 -177.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.79 -40.42 92.53 Favored 'General case' 0 C--N 1.329 -0.316 0 O-C-N 124.007 0.817 . . . . 0.0 109.865 -179.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 19.5 tttp -49.17 -70.69 0.08 Allowed 'General case' 0 C--O 1.221 -0.425 0 O-C-N 123.888 0.742 . . . . 0.0 111.994 179.126 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . 0.26 16.6 m170 27.97 -100.92 0.01 OUTLIER 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 115.324 1.602 . . . . 0.0 115.324 -174.268 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 78.9 mt -166.46 179.95 5.27 Favored 'General case' 0 C--N 1.325 -0.487 0 C-N-CA 126.084 1.754 . . . . 0.0 106.762 179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 1.4 pmm? -75.93 -8.41 56.85 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.783 0.802 . . . . 0.0 110.293 178.091 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 61.8 ttt180 -63.08 -47.24 83.73 Favored 'General case' 0 C--N 1.31 -1.136 0 C-N-CA 124.76 1.224 . . . . 0.0 110.392 175.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . 0.523 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 3.3 m-20 -71.34 43.71 0.08 Allowed 'General case' 0 C--N 1.285 -2.203 0 C-N-CA 126.647 1.979 . . . . 0.0 115.78 -172.567 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -67.57 -39.77 84.91 Favored 'General case' 0 C--O 1.247 0.929 0 N-CA-C 109.666 -0.494 . . . . 0.0 109.666 176.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 17.0 t70 -58.21 -52.53 65.17 Favored 'General case' 0 C--O 1.205 -1.282 0 CA-C-N 115.133 -0.94 . . . . 0.0 109.242 173.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.523 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 3.4 m -56.92 -42.73 80.51 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 124.661 1.184 . . . . 0.0 111.22 -177.38 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . 0.463 ' CE1' ' HE2' ' A' ' 491' ' ' TYR . 84.0 t80 -51.3 -56.61 12.11 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 123.637 0.775 . . . . 0.0 109.719 175.483 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 63.7 mt -74.81 -28.3 60.66 Favored 'General case' 0 C--N 1.308 -1.209 0 O-C-N 122.085 -0.384 . . . . 0.0 111.341 -177.818 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -69.81 -27.12 64.62 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-O 121.288 0.566 . . . . 0.0 110.859 -177.839 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -83.22 -40.31 19.79 Favored 'General case' 0 N--CA 1.414 -2.233 0 C-N-CA 120.084 -0.646 . . . . 0.0 109.318 177.28 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . 0.463 ' HE2' ' CE1' ' A' ' 487' ' ' PHE . 42.1 m-85 -58.01 -32.64 68.13 Favored 'General case' 0 N--CA 1.451 -0.415 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 175.577 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 15.5 pt-20 -77.71 -38.85 46.41 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 120.593 -0.443 . . . . 0.0 111.607 -179.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 17.8 t -87.23 -39.28 15.58 Favored 'General case' 0 C--O 1.249 1.074 0 N-CA-C 112.572 0.582 . . . . 0.0 112.572 -173.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 41.9 t -92.97 166.66 1.74 Allowed 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 -175.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -80.27 117.39 21.0 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 57.5 mttp -67.96 -44.37 76.87 Favored 'General case' 0 C--N 1.309 -1.171 0 CA-C-N 115.173 -0.921 . . . . 0.0 111.078 -176.399 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -63.07 -53.86 47.03 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 114.328 1.232 . . . . 0.0 114.328 -169.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -76.69 -35.0 58.17 Favored 'General case' 0 C--N 1.309 -1.18 0 C-N-CA 120.309 -0.556 . . . . 0.0 111.176 -174.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . 0.442 ' CZ ' HG23 ' A' ' 563' ' ' ILE 0.262 37.2 m-85 -78.6 -15.25 58.75 Favored 'General case' 0 N--CA 1.441 -0.889 0 N-CA-C 115.046 1.499 . . . . 0.0 115.046 -178.357 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 57.4 m -77.04 86.91 3.54 Favored 'General case' 0 N--CA 1.44 -0.948 0 C-N-CA 118.737 -1.185 . . . . 0.0 108.379 173.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 91.4 m-20 -84.45 -178.2 6.84 Favored 'General case' 0 C--O 1.208 -1.112 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 177.13 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 53.3 tp60 -63.15 -35.38 80.1 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 177.309 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 32.7 m170 -59.31 -56.92 15.9 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 113.565 -1.652 . . . . 0.0 108.422 177.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . 0.53 ' CZ ' ' HB3' ' A' ' 473' ' ' GLU 0.309 57.6 m-85 -66.73 -26.83 67.19 Favored 'General case' 0 N--CA 1.421 -1.88 0 N-CA-C 115.379 1.622 . . . . 0.0 115.379 178.865 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 36.1 tttm -63.0 -47.6 82.41 Favored 'General case' 0 CA--C 1.488 -1.428 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 175.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.567 ' O ' HG23 ' A' ' 510' ' ' VAL . 9.2 m-85 -52.51 -60.7 2.92 Favored 'General case' 0 N--CA 1.439 -1.022 0 O-C-N 124.506 1.129 . . . . 0.0 110.937 178.816 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . 0.47 HG22 ' HA ' ' A' ' 504' ' ' PHE . 22.7 m -65.45 -44.81 94.23 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.612 0 N-CA-C 113.907 1.077 . . . . 0.0 113.907 -176.259 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 46.8 t80 -50.49 -51.83 43.7 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.094 0.557 . . . . 0.0 110.604 176.164 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -57.74 -51.93 67.52 Favored 'General case' 0 N--CA 1.436 -1.148 0 CA-C-N 115.016 -0.993 . . . . 0.0 110.541 -177.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.567 HG23 ' O ' ' A' ' 506' ' ' TYR . 21.8 t -62.42 -47.6 92.26 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.519 0 O-C-N 123.475 0.484 . . . . 0.0 111.764 -179.008 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.468 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 3.8 tt -68.2 -41.33 81.53 Favored 'General case' 0 N--CA 1.443 -0.777 0 C-N-CA 120.045 -0.662 . . . . 0.0 109.859 -174.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 45.7 t-80 -66.53 -41.98 87.94 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 116.29 -0.414 . . . . 0.0 110.376 179.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -64.23 -49.33 72.36 Favored 'General case' 0 CA--C 1.501 -0.907 0 C-N-CA 123.272 0.629 . . . . 0.0 110.763 -179.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 15.7 m-30 -61.63 -46.96 87.54 Favored 'General case' 0 C--O 1.177 -2.738 0 CA-C-N 115.534 -0.757 . . . . 0.0 109.946 177.073 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . 0.468 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 0.5 OUTLIER -48.29 -39.94 23.32 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.761 0.824 . . . . 0.0 110.0 -179.323 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.15 -56.52 5.92 Favored 'General case' 0 N--CA 1.442 -0.845 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.467 178.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -95.48 -11.06 28.14 Favored 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 113.207 0.817 . . . . 0.0 113.207 -169.046 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -150.96 -151.29 0.38 Allowed 'General case' 0 C--N 1.29 -1.997 0 N-CA-C 106.449 -1.686 . . . . 0.0 106.449 -175.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -97.38 -162.95 1.0 Allowed 'General case' 0 C--N 1.306 -1.32 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 176.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 25.9 mp0 -83.77 -170.69 3.2 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 118.431 0.56 . . . . 0.0 112.299 -175.183 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 1.2 t80 -41.69 118.78 1.15 Allowed 'General case' 0 N--CA 1.418 -2.069 0 N-CA-C 115.559 1.689 . . . . 0.0 115.559 -178.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 33.6 m-80 -107.27 111.55 23.98 Favored 'General case' 0 N--CA 1.415 -2.194 0 N-CA-C 106.29 -1.744 . . . . 0.0 106.29 172.704 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 30.7 pt -54.78 -28.04 19.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.845 0 C-N-CA 125.098 1.359 . . . . 0.0 112.901 -174.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 10.2 m -58.51 -31.52 67.96 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.563 177.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -69.06 -36.65 77.91 Favored 'General case' 0 C--O 1.245 0.852 0 N-CA-C 108.118 -1.067 . . . . 0.0 108.118 178.24 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.634 ' HA ' ' CD2' ' A' ' 529' ' ' TYR . . . -61.52 -35.6 78.18 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 114.492 -1.231 . . . . 0.0 111.04 178.336 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 52.3 t -67.91 -34.86 69.71 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.496 0 C-N-CA 124.381 1.072 . . . . 0.0 108.996 176.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 21.1 mt-30 -66.44 -20.74 66.13 Favored 'General case' 0 N--CA 1.467 0.419 0 N-CA-C 109.441 -0.577 . . . . 0.0 109.441 177.051 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.634 ' CD2' ' HA ' ' A' ' 526' ' ' ALA . 18.9 m-85 -74.65 7.14 3.22 Favored 'General case' 0 CA--C 1.514 -0.414 0 CA-C-N 116.249 -0.432 . . . . 0.0 111.172 173.33 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.467 ' HA ' ' CB ' ' A' ' 536' ' ' ARG . 8.1 p -72.9 14.25 0.15 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.625 0 CA-C-O 122.334 1.064 . . . . 0.0 110.411 173.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . 0.437 ' H ' ' C ' ' A' ' 529' ' ' TYR . 46.3 m-80 -101.35 -21.18 14.91 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 174.584 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . 0.549 ' OG ' ' HB2' ' A' ' 535' ' ' LEU . 80.9 p -83.91 157.89 21.79 Favored 'General case' 0 C--O 1.222 -0.363 0 N-CA-C 109.499 -0.556 . . . . 0.0 109.499 -178.264 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 92.3 m-20 -63.5 -61.92 2.01 Favored 'General case' 0 N--CA 1.482 1.126 0 N-CA-C 114.022 1.119 . . . . 0.0 114.022 -174.291 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 40.5 tt0 -94.23 -40.5 9.97 Favored 'General case' 0 C--N 1.308 -1.208 0 N-CA-C 112.119 0.414 . . . . 0.0 112.119 -173.789 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.549 ' HB2' ' OG ' ' A' ' 532' ' ' SER . 99.5 mt -62.99 -22.66 67.0 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 -174.79 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.467 ' CB ' ' HA ' ' A' ' 530' ' ' VAL . 18.0 ptp180 -59.61 -42.84 93.54 Favored 'General case' 0 CA--C 1.53 0.195 0 CA-C-O 121.428 0.632 . . . . 0.0 109.567 177.179 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 42.2 mm-40 -70.53 -56.53 6.33 Favored 'General case' 0 N--CA 1.426 -1.649 0 CA-C-N 114.981 -1.009 . . . . 0.0 110.274 -177.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.442 ' O ' HD13 ' A' ' 542' ' ' LEU . 12.9 m -59.12 -53.65 55.92 Favored 'General case' 0 N--CA 1.431 -1.375 0 CA-C-N 115.468 -0.787 . . . . 0.0 112.375 -176.486 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . 0.511 ' HB3' ' HB1' ' A' ' 526' ' ' ALA 0.262 4.4 mm? -61.72 -38.91 89.63 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.717 1.377 . . . . 0.0 114.717 -177.232 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . 0.578 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 69.4 mt -69.04 -36.77 75.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 C-N-CA 119.353 -0.939 . . . . 0.0 110.052 176.665 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 57.5 m -56.17 -43.52 78.46 Favored 'General case' 0 N--CA 1.473 0.696 0 CA-C-O 121.524 0.678 . . . . 0.0 109.617 173.149 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.442 HD13 ' O ' ' A' ' 538' ' ' THR . 8.8 mp -65.63 -31.23 72.15 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-N 115.282 -0.872 . . . . 0.0 112.114 176.889 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -70.9 -41.42 71.3 Favored 'General case' 0 C--N 1.317 -0.844 0 O-C-N 122.086 -0.384 . . . . 0.0 110.772 177.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . 0.578 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 76.5 mt-30 -69.9 -27.87 65.15 Favored 'General case' 0 N--CA 1.467 0.411 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.195 -177.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 21.4 t80 -67.48 118.59 11.02 Favored 'General case' 0 C--N 1.309 -1.184 0 N-CA-C 105.96 -1.867 . . . . 0.0 105.96 174.351 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -124.7 130.67 52.85 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 113.913 1.079 . . . . 0.0 113.913 -168.165 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 61.9 tp -75.24 -27.89 59.66 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.956 -178.15 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -73.17 -36.81 66.67 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 120.806 -0.357 . . . . 0.0 111.058 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -68.73 -55.25 11.96 Favored 'General case' 0 CA--C 1.508 -0.673 0 CA-C-N 116.179 -0.464 . . . . 0.0 111.382 178.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -125.53 114.5 25.26 Favored Pre-proline 0 C--N 1.298 -1.654 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -60.74 151.74 74.49 Favored 'Trans proline' 0 C--O 1.249 1.041 0 C-N-CA 122.585 2.19 . . . . 0.0 111.333 175.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 54.7 m-85 -126.89 49.86 2.02 Favored 'General case' 0 C--N 1.301 -1.501 0 CA-C-O 121.824 0.821 . . . . 0.0 111.307 -174.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.96 -12.63 60.0 Favored 'General case' 0 C--N 1.285 -2.23 0 CA-C-O 121.667 0.746 . . . . 0.0 112.314 178.737 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 3.6 t-20 -79.29 -22.29 44.84 Favored 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 124.489 1.116 . . . . 0.0 108.789 173.477 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -39.07 -69.36 0.13 Allowed 'General case' 0 C--O 1.199 -1.56 0 C-N-CA 125.331 1.453 . . . . 0.0 111.585 -175.655 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 38.8 pt -54.1 -39.68 42.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.743 0 O-C-N 123.724 0.64 . . . . 0.0 112.193 -175.744 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -61.35 -55.01 36.47 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 123.951 0.9 . . . . 0.0 110.995 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -73.96 -35.89 64.56 Favored 'General case' 0 C--N 1.305 -1.362 0 CA-C-N 115.249 -0.887 . . . . 0.0 110.326 -175.58 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . 0.647 ' CE1' HD12 ' A' ' 563' ' ' ILE . 93.4 t80 -57.25 -52.74 64.11 Favored 'General case' 0 C--N 1.305 -1.34 0 C-N-CA 125.164 1.386 . . . . 0.0 111.648 177.977 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 14.4 p -64.21 -38.37 82.3 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.456 0 N-CA-C 109.811 -0.441 . . . . 0.0 109.811 -179.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.483 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 27.1 t-20 -61.76 -45.41 94.02 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-N 115.604 -0.725 . . . . 0.0 111.476 178.422 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 66.0 t -72.54 -50.47 34.4 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.772 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -178.27 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.647 HD12 ' CE1' ' A' ' 559' ' ' TYR . 30.5 mt -95.85 -45.74 13.12 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.118 0 CA-C-O 121.793 0.806 . . . . 0.0 111.638 -167.897 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 24.7 t-20 -81.24 6.75 13.11 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-O 122.485 1.136 . . . . 0.0 108.076 -175.11 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.483 ' HB2' ' O ' ' A' ' 561' ' ' ASN . 4.2 tm-20 -57.91 -39.12 77.16 Favored 'General case' 0 N--CA 1.442 -0.832 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 169.309 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -81.04 54.97 2.35 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.955 -1.475 . . . . 0.0 113.145 -178.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . 173.91 66.63 0.05 OUTLIER Glycine 0 N--CA 1.449 -0.45 0 C-N-CA 118.79 -1.671 . . . . 0.0 115.215 176.463 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 5.2 pp0? -118.78 142.9 47.27 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 117.832 0.816 . . . . 0.0 109.126 173.249 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -116.64 -38.91 3.39 Favored 'General case' 0 C--N 1.301 -1.541 0 C-N-CA 120.822 -0.351 . . . . 0.0 111.935 -179.508 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . 0.445 HG22 ' H ' ' A' ' 572' ' ' GLU . 94.5 m -129.07 161.67 29.46 Favored 'General case' 0 C--N 1.307 -1.249 0 C-N-CA 123.163 0.585 . . . . 0.0 109.579 -179.335 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 11.8 tt -54.89 -44.96 75.03 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.888 0 C-N-CA 123.987 0.915 . . . . 0.0 111.253 175.293 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . 0.445 ' H ' HG22 ' A' ' 570' ' ' THR . 30.9 mt-10 -67.52 -23.73 65.48 Favored 'General case' 0 C--O 1.208 -1.09 0 CA-C-O 119.042 -0.504 . . . . 0.0 112.099 177.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 8.4 m -62.28 -34.28 76.25 Favored 'General case' 0 C--O 1.206 -1.218 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 72.0 mt -60.95 -56.85 16.22 Favored 'General case' 0 C--O 1.233 0.19 0 N-CA-C 109.233 -0.655 . . . . 0.0 109.233 175.089 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . 0.462 ' O ' ' HG3' ' A' ' 579' ' ' ARG . 14.4 m120 -59.64 -51.56 69.28 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 115.045 -0.979 . . . . 0.0 111.576 -177.985 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 18.4 m170 -60.33 -39.51 87.31 Favored 'General case' 0 C--N 1.315 -0.903 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.045 -177.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -61.27 -48.12 82.87 Favored 'General case' 0 CA--C 1.508 -0.666 0 O-C-N 123.531 0.519 . . . . 0.0 110.483 178.787 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 96.1 mt -57.74 -48.55 79.3 Favored 'General case' 0 CA--C 1.516 -0.33 0 O-C-N 123.663 0.602 . . . . 0.0 109.984 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.462 ' HG3' ' O ' ' A' ' 575' ' ' ASN . 98.4 mtt180 -60.17 -57.85 11.04 Favored 'General case' 0 C--O 1.182 -2.48 0 CA-C-N 115.015 -0.993 . . . . 0.0 110.667 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -70.45 -34.33 72.32 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -170.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -66.1 -56.48 11.28 Favored 'General case' 0 N--CA 1.475 0.781 0 CA-C-O 122.001 0.905 . . . . 0.0 110.382 175.596 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . . . . . . . . . 3.6 m -68.39 -21.34 64.7 Favored 'General case' 0 CA--C 1.558 1.253 0 C-N-CA 126.084 1.753 . . . . 0.0 111.843 -177.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.405 ' O ' ' HA ' ' A' ' 591' ' ' LYS . 67.9 ttt180 -24.22 -59.86 0.05 Allowed 'General case' 0 CA--C 1.479 -1.752 0 C-N-CA 130.57 3.548 . . . . 0.0 117.587 -163.087 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.501 ' HB ' ' HA ' ' A' ' 587' ' ' VAL . 46.7 pt -84.62 -52.62 12.3 Favored 'Isoleucine or valine' 0 C--N 1.278 -2.535 0 C-N-CA 116.99 -1.884 . . . . 0.0 112.752 -175.583 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 65.59 -57.37 0.13 Allowed Glycine 0 CA--C 1.548 2.128 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 -170.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . 0.434 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 20.2 t70 -144.36 115.64 8.0 Favored 'General case' 0 C--N 1.309 -1.163 0 N-CA-C 103.725 -2.695 . . . . 0.0 103.725 172.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.501 ' HA ' ' HB ' ' A' ' 584' ' ' ILE 0.349 11.2 p -30.14 -87.58 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.575 1.911 0 N-CA-C 118.555 2.798 . . . . 0.0 118.555 -163.809 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.515 ' O ' ' HG2' ' A' ' 591' ' ' LYS . 69.8 mm-40 -69.66 -62.03 1.55 Allowed 'General case' 0 C--O 1.268 2.029 0 N-CA-C 115.116 1.524 . . . . 0.0 115.116 -170.909 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 41.9 tp -67.27 -52.21 43.53 Favored 'General case' 0 C--N 1.307 -1.253 0 CA-C-N 115.075 -0.966 . . . . 0.0 111.416 -170.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . 0.434 ' HB3' ' O ' ' A' ' 586' ' ' ASP . 57.3 tp60 -64.48 -34.41 78.14 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-O 118.408 -0.806 . . . . 0.0 112.586 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.515 ' HG2' ' O ' ' A' ' 588' ' ' GLU . 21.4 pttm -60.23 -39.13 85.56 Favored 'General case' 0 C--N 1.374 1.658 0 C-N-CA 119.13 -1.028 . . . . 0.0 109.705 179.642 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -59.39 -55.03 39.82 Favored 'General case' 0 N--CA 1.449 -0.521 0 CA-C-N 115.95 -0.568 . . . . 0.0 110.502 177.268 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 77.8 m-85 -63.94 -41.01 97.73 Favored 'General case' 0 C--O 1.213 -0.859 0 N-CA-C 113.423 0.897 . . . . 0.0 113.423 -179.225 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.442 ' O ' HG23 ' A' ' 598' ' ' VAL . 3.5 tm? -57.22 -50.96 71.24 Favored 'General case' 0 C--N 1.318 -0.797 0 C-N-CA 122.426 0.29 . . . . 0.0 110.857 -177.739 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -67.49 -30.65 70.39 Favored 'General case' 0 C--N 1.316 -0.881 0 C-N-CA 120.077 -0.649 . . . . 0.0 111.381 -178.046 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . 0.677 ' HA ' HE21 ' A' ' 596' ' ' GLN . 0.0 OUTLIER -66.15 -50.48 63.82 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.964 176.527 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 1.7 mp -56.05 -50.0 72.42 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.838 0 CA-C-N 115.693 -0.685 . . . . 0.0 111.436 177.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . 0.442 HG23 ' O ' ' A' ' 594' ' ' LEU . 26.1 t -66.5 -33.03 60.76 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.259 0 CA-C-O 120.917 0.389 . . . . 0.0 111.123 -178.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -65.77 -45.23 83.26 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-O 120.903 0.382 . . . . 0.0 110.382 175.095 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.09 -32.96 74.73 Favored 'General case' 0 C--O 1.214 -0.787 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.203 179.037 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 6.4 t30 -63.15 -40.04 96.41 Favored 'General case' 0 N--CA 1.475 0.809 0 CA-C-O 121.657 0.741 . . . . 0.0 109.408 175.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . . . . . . . . . 12.0 tmtt? -68.75 -47.89 65.11 Favored 'General case' 0 C--N 1.309 -1.153 0 CA-C-N 114.825 -1.079 . . . . 0.0 110.92 178.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 32.6 mm-40 -75.08 -7.63 54.27 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 113.159 0.8 . . . . 0.0 113.159 178.082 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 54.5 ttp180 -67.14 -40.18 86.68 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 175.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 24.9 ttt . . . . . 0 C--O 1.253 1.266 0 O-C-N 124.791 1.307 . . . . 0.0 111.074 175.524 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 99.8 m-85 . . . . . 0 N--CA 1.447 -0.594 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -86.03 108.83 18.42 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.112 -1.069 . . . . 0.0 108.112 173.612 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 7.2 t30 -88.17 65.71 8.22 Favored 'General case' 0 C--N 1.311 -1.102 0 CA-C-O 122.055 0.931 . . . . 0.0 110.604 -176.824 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . 0.533 HD12 ' O ' ' A' ' 466' ' ' LEU . 3.2 pp -74.98 107.64 7.18 Favored 'General case' 0 N--CA 1.417 -2.091 0 CA-C-N 114.114 -1.403 . . . . 0.0 108.156 169.171 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . 0.52 ' HB2' ' OE1' ' A' ' 469' ' ' GLN . 4.0 p -109.64 162.86 14.02 Favored 'General case' 0 C--N 1.279 -2.496 0 N-CA-C 113.195 0.813 . . . . 0.0 113.195 -176.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . 0.549 ' O ' ' HB2' ' A' ' 471' ' ' LYS . 4.3 ptp180 -64.93 -18.08 64.92 Favored 'General case' 0 N--CA 1.467 0.395 0 CA-C-O 121.252 0.548 . . . . 0.0 112.076 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.52 ' OE1' ' HB2' ' A' ' 467' ' ' SER . 26.3 mp0 -65.15 -27.23 68.57 Favored 'General case' 0 C--N 1.31 -1.122 0 O-C-N 122.072 -0.393 . . . . 0.0 111.922 -179.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.442 ' HA ' ' OE1' ' A' ' 473' ' ' GLU . 2.3 mp0 -67.02 -25.46 66.3 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 120.983 0.421 . . . . 0.0 111.274 173.289 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.549 ' HB2' ' O ' ' A' ' 468' ' ' ARG . 16.6 mmtp -67.94 -41.1 83.07 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 173.397 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -65.23 -46.24 81.45 Favored 'General case' 0 N--CA 1.448 -0.572 0 CA-C-N 115.399 -0.819 . . . . 0.0 110.368 178.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . 0.579 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 50.1 mt-10 -54.28 -58.46 7.3 Favored 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 175.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 41.3 ttt-85 -51.37 -35.26 37.75 Favored 'General case' 0 N--CA 1.484 1.226 0 N-CA-C 112.527 0.566 . . . . 0.0 112.527 178.394 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . 0.624 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -62.27 -51.85 66.08 Favored 'General case' 0 N--CA 1.454 -0.267 0 N-CA-C 110.402 -0.222 . . . . 0.0 110.402 179.72 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -63.51 -44.34 94.59 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-O 121.71 0.767 . . . . 0.0 112.056 176.17 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.579 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 61.2 mt -73.4 -9.02 58.26 Favored 'General case' 0 C--N 1.299 -1.613 0 N-CA-C 114.447 1.277 . . . . 0.0 114.447 -173.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.624 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 24.7 pttm -74.38 -0.6 17.79 Favored 'General case' 0 N--CA 1.475 0.815 0 O-C-N 121.596 -0.69 . . . . 0.0 112.164 179.481 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.411 ' HB2' ' OD1' ' A' ' 483' ' ' ASP . 6.2 p80 -142.75 108.76 5.19 Favored 'General case' 0 C--N 1.309 -1.155 0 C-N-CA 124.118 0.967 . . . . 0.0 108.81 -179.849 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.519 HD13 HD21 ' A' ' 511' ' ' LEU . 93.0 mt -138.04 8.03 2.71 Favored 'General case' 0 C--O 1.217 -0.656 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -172.904 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 82.9 mtp -94.49 -66.16 0.93 Allowed 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 119.714 -0.795 . . . . 0.0 111.743 -178.9 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 32.5 tpt180 -71.9 -29.15 64.03 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-O 122.685 1.231 . . . . 0.0 109.862 177.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . 0.537 ' HB3' ' HB ' ' A' ' 486' ' ' THR . 9.3 m-20 -71.11 51.52 0.16 Allowed 'General case' 0 C--N 1.288 -2.091 0 C-N-CA 127.834 2.453 . . . . 0.0 115.424 -172.624 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 38.0 mtmm -66.19 -39.61 89.83 Favored 'General case' 0 C--N 1.32 -0.701 0 N-CA-C 107.989 -1.115 . . . . 0.0 107.989 174.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -55.26 -46.05 76.12 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-N 114.045 -1.434 . . . . 0.0 109.538 176.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.537 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 23.5 m -65.53 -40.98 93.55 Favored 'General case' 0 N--CA 1.428 -1.569 0 C-N-CA 123.494 0.718 . . . . 0.0 111.774 -177.506 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . 0.406 ' CE2' ' HE1' ' A' ' 491' ' ' TYR . 37.8 t80 -60.49 -47.65 85.23 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.474 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 4.2 mm? -69.05 -31.57 70.43 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 116.337 -0.392 . . . . 0.0 111.904 178.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 43.0 t30 -72.11 -23.82 61.39 Favored 'General case' 0 C--N 1.31 -1.129 0 CA-C-O 121.268 0.556 . . . . 0.0 110.145 177.317 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -83.48 -23.69 32.09 Favored 'General case' 0 N--CA 1.388 -3.555 0 N-CA-C 108.635 -0.876 . . . . 0.0 108.635 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . 0.474 ' HB2' ' O ' ' A' ' 488' ' ' LEU . 28.9 m-85 -62.2 -42.38 99.24 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.667 -0.864 . . . . 0.0 108.667 167.625 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 17.1 mm-40 -70.84 -44.18 67.0 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 115.21 -0.905 . . . . 0.0 111.556 -178.579 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 19.8 m -78.33 -8.87 58.92 Favored 'General case' 0 C--N 1.302 -1.499 0 N-CA-C 113.642 0.978 . . . . 0.0 113.642 -174.712 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 87.4 t -122.17 107.83 20.58 Favored 'Isoleucine or valine' 0 C--O 1.249 1.04 0 CA-C-O 121.14 0.495 . . . . 0.0 110.753 -177.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . 0.272 6.9 p30 -150.67 -84.04 0.09 Allowed 'General case' 0 CA--C 1.536 0.423 0 N-CA-C 113.755 1.02 . . . . 0.0 113.755 178.687 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.447 ' N ' ' HD2' ' A' ' 496' ' ' LYS . 4.0 mptp? -76.73 -13.91 59.99 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-O 121.801 0.81 . . . . 0.0 112.059 -177.424 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -72.46 23.91 0.05 Allowed 'General case' 0 C--N 1.295 -1.794 0 C-N-CA 125.977 1.711 . . . . 0.0 111.533 173.415 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . 0.427 ' H ' ' C ' ' A' ' 496' ' ' LYS . 4.2 p-10 -77.72 18.08 0.49 Allowed 'General case' 0 C--N 1.318 -0.801 0 C-N-CA 123.722 0.809 . . . . 0.0 112.092 -176.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . 0.418 ' CE1' ' HD3' ' A' ' 566' ' ' LYS . 23.4 p90 -77.79 -22.56 49.94 Favored 'General case' 0 C--O 1.244 0.809 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 175.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . 0.525 ' HB ' ' CE2' ' A' ' 504' ' ' PHE . 3.9 m -67.48 156.57 36.31 Favored 'General case' 0 N--CA 1.427 -1.606 0 CA-C-N 114.088 -1.414 . . . . 0.0 109.56 179.117 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.517 ' C ' ' H ' ' A' ' 503' ' ' HIS . 28.4 t-20 -65.72 164.36 14.7 Favored 'General case' 0 C--N 1.303 -1.456 0 C-N-CA 124.496 1.118 . . . . 0.0 111.866 -175.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . 0.519 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 7.8 pt20 -58.6 14.32 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 127.201 2.2 . . . . 0.0 113.85 177.731 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . 0.517 ' H ' ' C ' ' A' ' 501' ' ' ASN . 7.8 t-160 -64.3 -55.47 21.13 Favored 'General case' 0 N--CA 1.424 -1.752 0 N-CA-C 106.582 -1.636 . . . . 0.0 106.582 -174.323 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . 0.525 ' CE2' ' HB ' ' A' ' 500' ' ' THR . 0.1 OUTLIER -61.18 -24.18 66.12 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 114.141 -1.39 . . . . 0.0 114.069 174.824 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.519 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 45.3 tttp -62.14 -52.07 65.31 Favored 'General case' 0 CA--C 1.498 -1.034 0 N-CA-C 108.813 -0.81 . . . . 0.0 108.813 -179.451 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.499 ' O ' HG23 ' A' ' 510' ' ' VAL 0.319 2.8 m-85 -69.12 -29.68 67.79 Favored 'General case' 0 N--CA 1.421 -1.896 0 N-CA-C 114.249 1.203 . . . . 0.0 114.249 178.524 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . 0.435 HG23 ' O ' ' A' ' 503' ' ' HIS . 82.2 t -63.25 -53.7 42.55 Favored 'Isoleucine or valine' 0 N--CA 1.436 -1.148 0 C-N-CA 120.205 -0.598 . . . . 0.0 109.793 175.353 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 40.3 m-85 -50.09 -53.88 24.23 Favored 'General case' 0 C--O 1.2 -1.536 0 O-C-N 123.166 0.291 . . . . 0.0 111.22 175.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 22.6 mt-10 -57.63 -60.05 4.26 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.941 1.46 . . . . 0.0 114.941 -176.737 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.499 HG23 ' O ' ' A' ' 506' ' ' TYR . 10.9 t -61.81 -43.38 97.22 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.623 0 C-N-CA 120.333 -0.547 . . . . 0.0 110.478 -176.381 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.519 HD21 HD13 ' A' ' 480' ' ' LEU . 10.4 mp -66.64 -49.13 67.24 Favored 'General case' 0 N--CA 1.441 -0.922 0 CA-C-N 115.919 -0.582 . . . . 0.0 111.753 -177.623 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -61.74 -46.92 87.54 Favored 'General case' 0 C--N 1.32 -0.697 0 C-N-CA 123.358 0.663 . . . . 0.0 110.047 -179.514 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -55.88 -48.67 75.16 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.951 0.5 . . . . 0.0 111.722 179.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 30.3 t80 -70.82 -45.14 65.12 Favored 'General case' 0 C--N 1.308 -1.218 0 CA-C-N 115.825 -0.625 . . . . 0.0 110.94 -178.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 2.5 t80 -52.59 -39.59 61.75 Favored 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 124.772 1.229 . . . . 0.0 109.434 175.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -64.63 -21.37 66.7 Favored 'General case' 0 N--CA 1.464 0.248 0 CA-C-N 115.806 -0.634 . . . . 0.0 112.046 -178.73 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -106.55 -56.46 2.19 Favored 'General case' 0 C--N 1.305 -1.365 0 CA-C-O 121.056 0.455 . . . . 0.0 111.141 -178.84 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 32.1 t-20 -117.58 -154.41 0.56 Allowed 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 109.241 -0.651 . . . . 0.0 109.241 -173.158 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . 0.422 ' CG ' ' H ' ' A' ' 520' ' ' GLN . 16.9 t70 -87.22 -159.82 0.54 Allowed 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 125.849 1.659 . . . . 0.0 107.984 -178.109 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . 0.422 ' H ' ' CG ' ' A' ' 519' ' ' ASP . 77.4 mm-40 -79.22 155.28 28.67 Favored 'General case' 0 C--N 1.294 -1.839 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -170.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -41.88 134.2 2.67 Favored 'General case' 0 N--CA 1.407 -2.597 0 C-N-CA 128.025 2.53 . . . . 0.0 116.255 -177.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 13.4 m120 -118.1 158.49 24.93 Favored 'General case' 0 N--CA 1.429 -1.51 0 N-CA-C 106.308 -1.738 . . . . 0.0 106.308 173.196 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 45.3 pt -68.48 -23.37 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 CA-C-O 121.583 0.706 . . . . 0.0 109.417 -179.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.442 ' HA ' HG12 ' A' ' 527' ' ' VAL . 3.0 m -56.35 -40.06 73.87 Favored 'General case' 0 N--CA 1.417 -2.109 0 C-N-CA 125.166 1.386 . . . . 0.0 110.891 177.566 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . 0.425 ' O ' ' HB3' ' A' ' 528' ' ' GLN . 15.9 m-20 -68.4 -33.88 75.02 Favored 'General case' 0 CA--C 1.509 -0.619 0 CA-C-O 121.328 0.585 . . . . 0.0 110.4 179.347 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -64.18 -47.89 78.07 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.802 -0.635 . . . . 0.0 110.642 177.235 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.442 HG12 ' HA ' ' A' ' 524' ' ' SER . 7.6 p -70.86 -18.22 20.72 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.106 0 CA-C-O 121.77 0.795 . . . . 0.0 110.374 176.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . 0.425 ' HB3' ' O ' ' A' ' 525' ' ' ASP . 0.7 OUTLIER -68.17 -31.58 71.23 Favored 'General case' 0 C--N 1.31 -1.12 0 N-CA-C 108.698 -0.853 . . . . 0.0 108.698 172.58 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.63 ' HB3' ' HG3' ' A' ' 536' ' ' ARG . 0.5 OUTLIER -85.21 11.38 10.07 Favored 'General case' 0 CA--C 1.569 1.686 0 CA-C-N 115.634 -0.712 . . . . 0.0 111.764 175.223 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.56 ' HA ' ' CZ ' ' A' ' 536' ' ' ARG . 2.9 p -72.94 4.98 0.71 Allowed 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 N-CA-C 115.684 1.735 . . . . 0.0 115.684 -171.572 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 8.4 t30 -109.0 -35.99 6.2 Favored 'General case' 0 C--N 1.298 -1.641 0 O-C-N 119.948 -1.72 . . . . 0.0 110.749 176.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . 0.589 ' O ' ' HG3' ' A' ' 534' ' ' GLU . 24.5 t -80.44 -145.2 0.05 OUTLIER 'General case' 0 CA--C 1.583 2.221 0 CA-C-N 114.474 -1.239 . . . . 0.0 110.342 -179.574 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . 0.465 ' O ' ' N ' ' A' ' 535' ' ' LEU 0.574 5.3 t-20 -25.34 39.02 0.0 OUTLIER 'General case' 0 CA--C 1.465 -2.325 1 C-N-CA 137.084 6.154 . . . . 0.0 121.61 179.905 . . . . . . . . 4 3 . 1 . 011 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . 0.746 ' HA ' ' HD3' ' A' ' 536' ' ' ARG . 45.9 mt-10 -28.97 6.41 0.0 OUTLIER 'General case' 0 N--CA 1.515 2.813 0 C-N-CA 129.19 2.996 . . . . 0.0 117.384 -177.592 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.465 ' N ' ' O ' ' A' ' 533' ' ' ASN . 1.0 OUTLIER -72.06 -21.48 61.51 Favored 'General case' 0 C--N 1.292 -1.91 0 N-CA-C 104.89 -2.263 . . . . 0.0 104.89 162.411 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.746 ' HD3' ' HA ' ' A' ' 534' ' ' GLU . 0.0 OUTLIER -69.59 -18.26 63.6 Favored 'General case' 0 C--N 1.383 2.052 0 N-CA-C 108.028 -1.101 . . . . 0.0 108.028 172.222 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . 0.51 ' N ' ' HD3' ' A' ' 536' ' ' ARG . 6.1 tp10 -76.95 -41.26 43.96 Favored 'General case' 0 CA--C 1.47 -2.117 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 -178.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.459 ' O ' HD13 ' A' ' 542' ' ' LEU . 27.6 m -54.96 -47.64 74.26 Favored 'General case' 0 N--CA 1.442 -0.873 0 O-C-N 124.05 0.844 . . . . 0.0 108.849 172.352 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 59.5 tp -56.48 -48.18 77.68 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 115.967 -0.56 . . . . 0.0 111.267 177.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . 0.439 HG13 ' O ' ' A' ' 536' ' ' ARG . 57.5 mt -63.72 -41.08 91.38 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.794 0 CA-C-O 120.744 0.307 . . . . 0.0 110.729 178.603 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 49.2 m -56.99 -46.44 82.24 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.684 0.754 . . . . 0.0 109.993 174.331 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.459 HD13 ' O ' ' A' ' 538' ' ' THR . 6.0 mp -67.53 -16.15 64.04 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 124.43 1.092 . . . . 0.0 112.652 177.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -88.26 -39.85 14.11 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 107.567 -1.271 . . . . 0.0 107.567 177.099 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -67.09 -36.78 82.71 Favored 'General case' 0 C--O 1.24 0.572 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.111 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -68.27 129.18 39.16 Favored 'General case' 0 C--N 1.309 -1.191 0 N-CA-C 104.383 -2.451 . . . . 0.0 104.383 170.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -74.95 109.06 8.09 Favored 'General case' 0 CA--C 1.502 -0.873 0 CA-C-O 122.382 1.087 . . . . 0.0 112.189 -168.531 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.428 ' H ' ' HG ' ' A' ' 547' ' ' LEU . 1.0 OUTLIER -78.96 -13.93 59.51 Favored 'General case' 0 C--N 1.307 -1.263 0 CA-C-N 113.3 -1.773 . . . . 0.0 113.505 -177.215 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -75.94 -6.98 53.48 Favored 'General case' 0 N--CA 1.476 0.852 0 CA-C-O 121.114 0.483 . . . . 0.0 110.666 178.39 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 34.7 t70 -72.59 -8.33 54.67 Favored 'General case' 0 CA--C 1.541 0.61 0 CA-C-N 115.697 -0.683 . . . . 0.0 111.888 -179.304 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -87.69 149.02 45.25 Favored Pre-proline 0 C--N 1.312 -1.054 0 N-CA-C 109.513 -0.551 . . . . 0.0 109.513 178.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . 0.42 ' O ' ' HB2' ' A' ' 554' ' ' ASN . 23.2 Cg_exo -66.84 129.43 20.87 Favored 'Trans proline' 0 C--N 1.347 0.465 0 C-N-CA 122.035 1.823 . . . . 0.0 107.99 172.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . 0.577 ' O ' ' HG2' ' A' ' 555' ' ' GLU . 21.6 t80 -82.84 -6.09 59.28 Favored 'General case' 0 C--N 1.309 -1.194 0 CA-C-O 121.937 0.875 . . . . 0.0 111.23 -172.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -82.88 -8.63 59.56 Favored 'General case' 0 C--N 1.3 -1.56 0 CA-C-O 121.773 0.797 . . . . 0.0 111.502 172.198 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . 0.42 ' HB2' ' O ' ' A' ' 551' ' ' PRO . 6.6 m-20 -73.04 -22.89 60.55 Favored 'General case' 0 C--O 1.198 -1.622 0 CA-C-N 115.102 -0.954 . . . . 0.0 111.357 177.076 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . 0.577 ' HG2' ' O ' ' A' ' 552' ' ' TYR . 18.6 mm-40 -40.0 -83.65 0.01 OUTLIER 'General case' 0 C--O 1.196 -1.73 0 N-CA-C 115.88 1.807 . . . . 0.0 115.88 -164.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . 0.473 ' H ' HD12 ' A' ' 556' ' ' ILE . 0.6 OUTLIER -67.59 -39.27 82.0 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.407 0 CA-C-O 121.573 0.701 . . . . 0.0 110.037 -176.722 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -58.88 -59.81 4.85 Favored 'General case' 0 C--N 1.311 -1.095 0 CA-C-N 114.18 -1.373 . . . . 0.0 112.341 -173.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 32.3 t70 -73.83 -39.25 64.17 Favored 'General case' 0 C--N 1.301 -1.514 0 CA-C-N 115.303 -0.862 . . . . 0.0 111.147 -176.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . 0.516 ' O ' HG13 ' A' ' 563' ' ' ILE . 93.5 t80 -50.34 -53.34 29.6 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.257 1.023 . . . . 0.0 111.018 177.983 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.4 t -64.69 -40.35 88.75 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.955 0 CA-C-N 115.758 -0.656 . . . . 0.0 110.768 179.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.446 ' O ' ' HB2' ' A' ' 565' ' ' GLU . 2.4 t-20 -59.04 -45.92 89.52 Favored 'General case' 0 C--O 1.194 -1.833 0 CA-C-O 119.331 -0.366 . . . . 0.0 110.58 175.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . 0.499 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 91.2 t -66.17 -33.15 61.63 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.804 0 N-CA-C 113.327 0.862 . . . . 0.0 113.327 -177.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.516 HG13 ' O ' ' A' ' 559' ' ' TYR . 14.4 mt -87.09 -31.74 6.12 Favored 'Isoleucine or valine' 0 C--N 1.29 -1.983 0 C-N-CA 118.205 -1.398 . . . . 0.0 108.907 -176.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . 0.416 ' HB3' ' HB ' ' A' ' 571' ' ' ILE . 78.5 m-20 -83.53 -2.25 55.56 Favored 'General case' 0 C--N 1.301 -1.503 0 CA-C-N 114.439 -1.255 . . . . 0.0 110.638 176.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.499 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 11.4 tp10 -73.6 -11.17 60.34 Favored 'General case' 0 N--CA 1.443 -0.817 0 CA-C-N 113.761 -1.563 . . . . 0.0 107.462 175.21 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . 0.418 ' HD3' ' CE1' ' A' ' 499' ' ' PHE . 38.4 ttpt -56.87 -35.11 68.53 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 114.834 -1.076 . . . . 0.0 109.047 172.976 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -113.66 -55.75 0.42 Allowed Glycine 0 N--CA 1.435 -1.379 0 C-N-CA 120.332 -0.937 . . . . 0.0 112.934 -178.047 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . 0.429 ' HA ' ' CD ' ' A' ' 572' ' ' GLU . 8.7 tt0 55.7 90.92 0.03 OUTLIER 'General case' 0 C--O 1.245 0.82 0 C-N-CA 123.781 0.832 . . . . 0.0 110.427 -173.525 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -170.54 -34.87 0.02 OUTLIER 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 116.075 -0.511 . . . . 0.0 111.67 -174.165 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 76.8 m -166.91 -19.08 0.02 OUTLIER 'General case' 0 CA--C 1.555 1.168 0 CA-C-O 121.739 0.78 . . . . 0.0 110.854 -168.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.416 ' HB ' ' HB3' ' A' ' 564' ' ' ASN . 0.0 OUTLIER -86.35 -19.44 8.27 Favored 'Isoleucine or valine' 0 C--N 1.307 -1.268 0 CA-C-O 122.191 0.996 . . . . 0.0 109.14 -171.228 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . 0.429 ' CD ' ' HA ' ' A' ' 568' ' ' GLN . 1.5 mp0 -71.1 -12.8 61.7 Favored 'General case' 0 C--N 1.306 -1.301 0 CA-C-N 114.83 -1.077 . . . . 0.0 109.112 174.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . 0.494 ' O ' ' HB2' ' A' ' 576' ' ' HIS . 22.5 t -62.99 -25.95 68.62 Favored 'General case' 0 N--CA 1.429 -1.482 0 N-CA-C 107.667 -1.235 . . . . 0.0 107.667 172.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.416 ' O ' ' HG ' ' A' ' 578' ' ' LEU . 9.3 mp -63.5 -32.86 74.43 Favored 'General case' 0 CA--C 1.548 0.888 0 CA-C-O 121.017 0.437 . . . . 0.0 110.634 172.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . 0.413 ' HA ' HD12 ' A' ' 578' ' ' LEU . 2.8 t-20 -64.19 -34.73 78.76 Favored 'General case' 0 N--CA 1.48 1.054 0 CA-C-O 121.657 0.741 . . . . 0.0 109.626 174.841 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . 0.494 ' HB2' ' O ' ' A' ' 573' ' ' SER . 13.4 m-70 -60.72 -44.88 96.08 Favored 'General case' 0 C--O 1.241 0.641 0 CA-C-N 115.601 -0.727 . . . . 0.0 109.388 175.163 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -57.18 -47.81 80.31 Favored 'General case' 0 C--O 1.22 -0.449 0 CA-C-N 115.379 -0.828 . . . . 0.0 109.854 176.203 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.437 ' O ' ' HB ' ' A' ' 582' ' ' THR . 89.1 mt -52.84 -45.08 67.19 Favored 'General case' 0 CA--C 1.492 -1.288 0 C-N-CA 123.231 0.612 . . . . 0.0 111.105 179.112 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.668 ' O ' ' HG2' ' A' ' 583' ' ' ARG . 0.0 OUTLIER -59.48 -57.16 14.2 Favored 'General case' 0 C--O 1.199 -1.556 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.35 179.313 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . 0.45 ' HG3' ' NH2' ' A' ' 579' ' ' ARG . 15.0 tt0 -73.41 -36.04 65.93 Favored 'General case' 0 C--N 1.292 -1.902 0 N-CA-C 114.451 1.278 . . . . 0.0 114.451 -170.452 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -68.05 -46.21 71.75 Favored 'General case' 0 C--N 1.291 -1.972 0 CA-C-O 121.472 0.654 . . . . 0.0 110.837 175.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.437 ' HB ' ' O ' ' A' ' 578' ' ' LEU . 84.9 m -88.71 -40.55 13.17 Favored 'General case' 0 C--N 1.305 -1.355 0 N-CA-C 119.543 3.164 . . . . 0.0 119.543 -170.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.668 ' HG2' ' O ' ' A' ' 579' ' ' ARG . 0.6 OUTLIER -43.21 -85.19 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.119 0 N-CA-C 116.19 1.922 . . . . 0.0 116.19 -159.1 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.549 ' C ' ' H ' ' A' ' 586' ' ' ASP . 12.8 pt -121.64 -17.33 5.63 Favored 'Isoleucine or valine' 0 C--N 1.27 -2.873 0 N-CA-C 115.115 1.524 . . . . 0.0 115.115 -174.164 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 74.13 -37.98 0.96 Allowed Glycine 0 CA--C 1.573 3.684 0 CA-C-O 122.468 1.038 . . . . 0.0 110.908 -166.41 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . 0.549 ' H ' ' C ' ' A' ' 584' ' ' ILE . 23.9 t70 -72.68 173.73 8.6 Favored 'General case' 0 C--O 1.194 -1.855 0 C-N-CA 131.63 3.972 . . . . 0.0 107.745 174.456 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.478 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 7.5 p -27.03 23.41 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.61 3.263 1 C-N-CA 132.85 4.46 . . . . 0.0 118.675 -174.796 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.536 ' HA ' ' HB2' ' A' ' 591' ' ' LYS 0.352 12.9 pt-20 -55.05 7.41 0.01 OUTLIER 'General case' 0 C--N 1.262 -3.209 0 N-CA-C 117.468 2.396 . . . . 0.0 117.468 179.465 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . 0.577 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 59.0 tp -71.5 -41.33 69.42 Favored 'General case' 0 C--N 1.294 -1.82 0 N-CA-C 105.687 -1.968 . . . . 0.0 105.687 162.494 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . 0.478 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 0.1 OUTLIER -55.07 -49.73 70.93 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 105.165 -2.161 . . . . 0.0 105.165 167.215 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.665 ' O ' ' HB3' ' A' ' 594' ' ' LEU 0.252 33.6 mmtp -72.95 -9.05 58.3 Favored 'General case' 0 CA--C 1.576 1.945 0 N-CA-C 114.106 1.15 . . . . 0.0 114.106 177.555 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.577 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 82.0 t80 -63.26 -39.56 94.94 Favored 'General case' 0 CA--C 1.506 -0.724 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 170.426 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 96.8 m-85 -54.74 -39.43 68.29 Favored 'General case' 0 CA--C 1.553 1.094 0 CA-C-N 114.899 -1.046 . . . . 0.0 111.164 171.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.665 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 10.2 tp -54.31 -46.25 72.78 Favored 'General case' 0 N--CA 1.5 2.034 0 CA-C-O 121.57 0.7 . . . . 0.0 109.463 175.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.456 ' HB2' ' HD3' ' A' ' 579' ' ' ARG . 35.1 tt0 -60.82 -37.48 82.16 Favored 'General case' 0 N--CA 1.435 -1.208 0 CA-C-N 114.253 -1.339 . . . . 0.0 110.999 -176.23 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . 0.489 ' O ' ' HD3' ' A' ' 600' ' ' LYS . 82.0 mm-40 -63.45 -47.87 80.06 Favored 'General case' 0 CA--C 1.511 -0.526 0 N-CA-C 109.514 -0.551 . . . . 0.0 109.514 175.334 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 84.8 mt -54.12 -52.64 35.47 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 115.568 -0.742 . . . . 0.0 110.262 177.199 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 97.9 t -63.99 -47.37 90.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 N-CA-C 112.602 0.593 . . . . 0.0 112.602 -177.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.421 ' O ' ' HG2' ' A' ' 603' ' ' GLU . . . -61.23 -41.38 96.77 Favored 'General case' 0 C--O 1.243 0.721 0 CA-C-N 118.296 0.498 . . . . 0.0 110.523 179.936 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . 0.489 ' HD3' ' O ' ' A' ' 596' ' ' GLN . 1.4 mptm? -67.18 -37.92 84.51 Favored 'General case' 0 CA--C 1.51 -0.564 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.029 176.546 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . 0.414 ' HA ' ' HB3' ' A' ' 604' ' ' ARG . 99.0 m-20 -71.81 -21.97 61.63 Favored 'General case' 0 C--N 1.318 -0.771 0 N-CA-C 112.942 0.719 . . . . 0.0 112.942 177.253 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -70.73 -47.97 56.92 Favored 'General case' 0 C--N 1.315 -0.914 0 C-N-CA 123.635 0.774 . . . . 0.0 109.451 177.514 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 599' ' ' ALA . 4.7 pt-20 -75.72 -19.62 58.95 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-O 121.757 0.789 . . . . 0.0 110.477 177.773 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . 0.452 ' HB2' ' O ' ' A' ' 600' ' ' LYS . 75.8 ttt180 -77.74 -8.69 58.33 Favored 'General case' 0 C--N 1.319 -0.749 0 C-N-CA 124.01 0.924 . . . . 0.0 109.691 178.142 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 15.2 tpt . . . . . 0 C--N 1.309 -1.175 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -177.443 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 . . . . . 0 C--O 1.241 0.628 0 CA-C-O 120.793 0.33 . . . . 0.0 110.794 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -81.15 163.65 22.94 Favored 'General case' 0 C--N 1.313 -0.992 0 N-CA-C 108.853 -0.795 . . . . 0.0 108.853 178.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 25.2 t-20 -133.98 83.82 2.07 Favored 'General case' 0 N--CA 1.428 -1.545 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -178.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 89.8 mt -63.13 120.93 12.41 Favored 'General case' 0 C--N 1.293 -1.858 0 CA-C-N 114.697 -1.138 . . . . 0.0 110.763 179.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 37.0 t -88.95 106.57 18.5 Favored 'General case' 0 N--CA 1.421 -1.906 0 N-CA-C 108.927 -0.768 . . . . 0.0 108.927 179.366 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 14.9 ptt180 -66.96 -36.93 83.31 Favored 'General case' 0 C--O 1.242 0.697 0 CA-C-N 115.571 -0.74 . . . . 0.0 111.432 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -68.23 -45.11 74.17 Favored 'General case' 0 C--O 1.198 -1.644 0 C-N-CA 120.301 -0.56 . . . . 0.0 110.743 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 28.2 mt-10 -66.26 -22.85 66.32 Favored 'General case' 0 C--N 1.322 -0.6 0 N-CA-C 114.774 1.398 . . . . 0.0 114.774 -177.262 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.408 ' HD3' ' C ' ' A' ' 471' ' ' LYS . 10.1 tmtt? -76.9 -37.39 55.54 Favored 'General case' 0 C--N 1.322 -0.612 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 172.738 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . 0.578 ' HB3' HD11 ' A' ' 563' ' ' ILE . . . -64.22 -51.82 61.81 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 115.196 -0.911 . . . . 0.0 110.31 178.273 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . 0.569 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 2.2 mp0 -53.42 -43.1 67.71 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 118.079 0.4 . . . . 0.0 110.961 176.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 61.5 mtt85 -53.82 -41.95 67.91 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 120.853 0.359 . . . . 0.0 111.183 172.447 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . 0.477 ' O ' ' HB3' ' A' ' 478' ' ' LYS . . . -71.23 -28.56 64.28 Favored 'General case' 0 C--O 1.216 -0.701 0 C-N-CA 122.965 0.506 . . . . 0.0 112.317 179.179 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -65.69 -35.06 79.68 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 121.663 -0.648 . . . . 0.0 110.171 176.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.569 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 45.9 mt -64.05 -8.99 13.56 Favored 'General case' 0 N--CA 1.494 1.771 0 C-N-CA 124.61 1.164 . . . . 0.0 112.178 -179.235 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.477 ' HB3' ' O ' ' A' ' 475' ' ' ALA . 80.3 tttt -71.31 -3.96 23.44 Favored 'General case' 0 CA--C 1.559 1.289 0 C-N-CA 125.656 1.582 . . . . 0.0 111.804 -179.926 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.488 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 16.9 m170 -96.58 152.47 18.61 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 -179.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 7.9 mp -122.34 -63.99 1.24 Allowed 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 64.0 mtt -95.21 -57.39 2.43 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 115.318 1.599 . . . . 0.0 115.318 -171.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 29.8 mmm180 -67.77 -12.7 61.11 Favored 'General case' 0 N--CA 1.489 1.525 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -173.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . 0.488 ' HB2' ' HB3' ' A' ' 479' ' ' HIS . 26.2 t70 -75.07 8.36 2.64 Favored 'General case' 0 C--O 1.184 -2.379 0 C-N-CA 124.572 1.149 . . . . 0.0 113.13 -175.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -46.72 -61.81 1.67 Allowed 'General case' 0 C--O 1.275 2.395 0 C-N-CA 124.113 0.965 . . . . 0.0 112.682 -174.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -62.84 -43.14 99.59 Favored 'General case' 0 N--CA 1.476 0.848 0 CA-C-N 115.664 -0.698 . . . . 0.0 110.631 177.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 28.1 m -60.81 -41.79 96.37 Favored 'General case' 0 C--N 1.308 -1.237 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.468 -177.105 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . 0.517 ' O ' ' HB2' ' A' ' 491' ' ' TYR . 39.0 t80 -59.7 -47.12 86.9 Favored 'General case' 0 CA--C 1.508 -0.65 0 C-N-CA 123.061 0.544 . . . . 0.0 109.843 175.368 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 70.9 mt -66.04 -34.55 78.34 Favored 'General case' 0 CA--C 1.539 0.532 0 CA-C-O 121.463 0.649 . . . . 0.0 110.533 179.083 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 37.5 t30 -67.15 -49.11 65.94 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.711 -179.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . 0.496 ' CZ ' ' HE1' ' A' ' 559' ' ' TYR . 1.3 m-85 -76.96 -8.64 57.74 Favored 'General case' 0 CA--C 1.494 -1.174 0 N-CA-C 113.776 1.028 . . . . 0.0 113.776 178.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . 0.517 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 0.4 OUTLIER -74.55 -52.39 12.0 Favored 'General case' 0 C--N 1.286 -2.185 0 CA-C-N 114.965 -1.016 . . . . 0.0 108.689 176.348 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -80.17 -27.86 38.9 Favored 'General case' 0 C--N 1.315 -0.9 0 N-CA-C 113.45 0.907 . . . . 0.0 113.45 -174.486 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 19.7 p -81.67 -24.42 36.29 Favored 'General case' 0 C--N 1.318 -0.784 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 -176.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 50.6 t -96.68 156.24 3.4 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.607 0 CA-C-O 121.086 0.47 . . . . 0.0 110.445 -175.653 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -85.91 124.44 32.38 Favored 'General case' 0 C--N 1.309 -1.179 0 N-CA-C 112.472 0.545 . . . . 0.0 112.472 -176.78 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.56 ' HA ' ' OG1' ' A' ' 500' ' ' THR . 62.3 pttt -88.75 -15.82 33.75 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.13 178.68 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 19.5 t70 -69.6 -70.93 0.25 Allowed 'General case' 0 C--N 1.328 -0.368 0 N-CA-C 113.116 0.784 . . . . 0.0 113.116 -175.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -106.9 -31.74 8.21 Favored 'General case' 0 C--N 1.303 -1.418 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.502 -174.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -72.66 -37.35 67.97 Favored 'General case' 0 C--N 1.319 -0.718 0 C-N-CA 120.38 -0.528 . . . . 0.0 110.67 -175.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . 0.56 ' OG1' ' HA ' ' A' ' 496' ' ' LYS . 76.1 m -71.66 102.45 2.78 Favored 'General case' 0 N--CA 1.431 -1.381 0 CA-C-O 121.887 0.851 . . . . 0.0 112.496 -179.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -77.13 163.16 26.85 Favored 'General case' 0 C--N 1.317 -0.829 0 CA-C-N 114.32 -1.309 . . . . 0.0 107.773 174.418 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -53.97 -34.84 60.89 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.966 0.803 . . . . 0.0 110.566 179.146 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 61.4 m80 -57.15 -56.11 25.97 Favored 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.981 175.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -66.13 -30.53 71.04 Favored 'General case' 0 CA--C 1.556 1.195 0 CA-C-N 115.433 -0.803 . . . . 0.0 110.736 -178.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 51.8 tttp -67.3 -47.71 69.77 Favored 'General case' 0 CA--C 1.503 -0.85 0 C-N-CA 124.12 0.968 . . . . 0.0 110.072 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.558 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -59.74 -45.91 90.75 Favored 'General case' 0 N--CA 1.425 -1.694 0 CA-C-N 115.61 -0.723 . . . . 0.0 110.869 -178.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 11.8 p -68.28 -40.96 83.39 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 O-C-N 123.428 0.455 . . . . 0.0 111.049 -176.664 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -51.28 -53.92 31.0 Favored 'General case' 0 CA--C 1.507 -0.71 0 CA-C-O 121.079 0.466 . . . . 0.0 110.558 173.413 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -62.37 -41.85 98.95 Favored 'General case' 0 N--CA 1.431 -1.42 0 CA-C-N 114.992 -1.004 . . . . 0.0 113.521 -179.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.558 HG23 ' O ' ' A' ' 506' ' ' TYR . 95.7 t -57.55 -52.45 57.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 CA-C-O 120.889 0.376 . . . . 0.0 110.814 176.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.5 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 10.2 mp -66.37 -38.69 88.13 Favored 'General case' 0 N--CA 1.433 -1.304 0 C-N-CA 119.935 -0.706 . . . . 0.0 111.949 -177.694 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 3.1 t-160 -62.99 -49.2 75.61 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 123.629 0.58 . . . . 0.0 109.555 177.462 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -52.64 -51.29 60.73 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.677 0.791 . . . . 0.0 110.75 -179.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 45.3 m-85 -64.11 -53.36 50.87 Favored 'General case' 0 C--O 1.187 -2.223 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.747 177.416 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . 0.5 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 3.6 t80 -52.0 -35.7 47.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.976 0.91 . . . . 0.0 110.968 -177.006 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -71.41 -25.26 62.26 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -179.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -117.28 -38.2 3.39 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.778 0.799 . . . . 0.0 111.951 -177.572 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -124.82 -153.09 0.54 Allowed 'General case' 0 C--N 1.285 -2.233 0 C-N-CA 124.802 1.241 . . . . 0.0 109.16 -171.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -85.2 -162.01 0.66 Allowed 'General case' 0 C--N 1.32 -0.693 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 176.521 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . 0.463 ' HG2' ' H ' ' A' ' 521' ' ' TYR . 8.3 tt0 -82.36 -169.74 2.58 Favored 'General case' 0 CA--C 1.547 0.834 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 -177.474 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . 0.463 ' H ' ' HG2' ' A' ' 520' ' ' GLN . 13.0 t80 -45.43 130.78 8.52 Favored 'General case' 0 N--CA 1.423 -1.823 0 C-N-CA 125.48 1.512 . . . . 0.0 114.266 -174.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 42.9 t-20 -118.14 134.41 55.03 Favored 'General case' 0 N--CA 1.431 -1.379 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 178.213 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 1.7 tt -53.72 -26.26 13.29 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 125.441 1.496 . . . . 0.0 112.029 179.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 48.1 t -54.34 -38.61 66.23 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 122.749 0.42 . . . . 0.0 111.548 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . 0.53 ' O ' ' HB3' ' A' ' 528' ' ' GLN . 2.8 t70 -72.04 -36.91 69.77 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 178.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -58.13 -55.53 33.77 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 115.691 -0.686 . . . . 0.0 111.132 178.67 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.445 ' O ' HG12 ' A' ' 530' ' ' VAL . 14.7 p -66.98 -18.84 24.84 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.083 0 CA-C-O 121.498 0.666 . . . . 0.0 111.423 179.296 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . 0.53 ' HB3' ' O ' ' A' ' 525' ' ' ASP . 48.1 tt0 -65.8 -37.75 87.1 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 171.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.444 ' C ' ' H ' ' A' ' 531' ' ' ASN . 76.8 m-85 -79.8 9.48 5.16 Favored 'General case' 0 C--N 1.315 -0.895 0 N-CA-C 113.814 1.042 . . . . 0.0 113.814 176.982 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 527' ' ' VAL . 5.3 p -74.3 16.84 0.12 Allowed 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 CA-C-O 122.413 1.102 . . . . 0.0 110.794 178.519 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . 0.444 ' H ' ' C ' ' A' ' 529' ' ' TYR . 91.2 m-20 -111.03 -29.57 7.84 Favored 'General case' 0 C--N 1.288 -2.079 0 CA-C-N 115.351 -0.84 . . . . 0.0 109.021 179.914 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 12.9 m -81.2 158.52 24.86 Favored 'General case' 0 C--N 1.307 -1.279 0 CA-C-N 115.556 -0.747 . . . . 0.0 109.696 -177.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . 0.48 ' O ' ' HG3' ' A' ' 537' ' ' GLU . 7.8 t30 -65.97 -73.55 0.13 Allowed 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 113.438 0.903 . . . . 0.0 113.438 -177.839 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -71.93 -32.33 67.23 Favored 'General case' 0 CA--C 1.489 -1.386 0 N-CA-C 113.749 1.018 . . . . 0.0 113.749 -172.07 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.409 ' H ' HD22 ' A' ' 535' ' ' LEU . 2.5 mm? -66.08 -38.53 88.52 Favored 'General case' 0 C--N 1.299 -1.623 0 N-CA-C 109.623 -0.51 . . . . 0.0 109.623 -178.314 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 11.6 ttm180 -64.4 -56.41 14.48 Favored 'General case' 0 N--CA 1.437 -1.089 0 N-CA-C 107.71 -1.218 . . . . 0.0 107.71 175.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . 0.48 ' HG3' ' O ' ' A' ' 533' ' ' ASN . 42.4 mt-10 -55.83 -70.19 0.12 Allowed 'General case' 0 C--N 1.347 0.468 0 CA-C-N 114.995 -1.002 . . . . 0.0 112.186 -177.771 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 8.9 m -64.31 -54.56 31.15 Favored 'General case' 0 N--CA 1.435 -1.211 0 N-CA-C 113.705 1.002 . . . . 0.0 113.705 -172.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 48.8 tp -63.99 -44.27 93.18 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 120.229 -0.588 . . . . 0.0 112.013 -173.069 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . 0.586 ' O ' ' HG3' ' A' ' 544' ' ' GLN . 64.8 mt -69.27 -28.23 37.82 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.907 0 C-N-CA 119.515 -0.874 . . . . 0.0 109.728 179.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . 0.47 ' HB2' ' O ' ' A' ' 537' ' ' GLU . 9.0 t -57.43 -44.32 84.57 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 109.402 -0.592 . . . . 0.0 109.402 174.184 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.515 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 3.1 mm? -67.47 -23.53 65.51 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 112.315 0.487 . . . . 0.0 112.315 176.183 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . 0.45 ' C ' ' H ' ' A' ' 545' ' ' TYR . 36.6 tt0 -76.63 -26.61 55.1 Favored 'General case' 0 CA--C 1.55 0.943 0 CA-C-O 121.349 0.595 . . . . 0.0 109.773 174.628 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . 0.586 ' HG3' ' O ' ' A' ' 540' ' ' ILE . 86.2 mt-30 -80.87 31.86 0.31 Allowed 'General case' 0 N--CA 1.5 2.048 0 C-N-CA 124.11 0.964 . . . . 0.0 110.368 177.268 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . 0.515 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 6.3 p90 -68.09 166.92 15.04 Favored 'General case' 0 N--CA 1.394 -3.27 0 CA-C-N 114.296 -1.32 . . . . 0.0 111.792 -175.559 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 27.4 p30 -79.22 156.0 28.35 Favored 'General case' 0 C--N 1.296 -1.748 0 CA-C-O 121.688 0.756 . . . . 0.0 112.304 -170.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' A' ' 549' ' ' ASP . 3.0 mm? -77.23 6.04 7.37 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.102 -177.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -79.39 21.9 0.46 Allowed 'General case' 0 C--N 1.309 -1.165 0 C-N-CA 125.162 1.385 . . . . 0.0 110.072 177.055 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . 0.405 ' H ' ' C ' ' A' ' 547' ' ' LEU . 3.2 p-10 -67.36 0.5 2.85 Favored 'General case' 0 C--O 1.238 0.46 0 N-CA-C 113.92 1.082 . . . . 0.0 113.92 -172.506 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -61.96 140.65 95.73 Favored Pre-proline 0 C--N 1.324 -0.528 0 N-CA-C 104.905 -2.257 . . . . 0.0 104.905 170.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 20.5 Cg_exo -0.64 66.34 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.094 1 C-N-CA 126.555 4.836 . . . . 0.0 115.532 -167.139 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -89.89 19.98 4.47 Favored 'General case' 0 CA--C 1.518 -0.278 0 CA-C-O 122.921 1.343 . . . . 0.0 109.76 -171.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . 0.418 ' H ' ' HG2' ' A' ' 553' ' ' GLU . 8.7 pt-20 -71.97 -4.6 29.44 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-N 113.577 -1.647 . . . . 0.0 110.854 177.411 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . 0.613 ' HA ' ' OD2' ' A' ' 557' ' ' ASP . 14.2 m120 -66.56 -23.07 66.16 Favored 'General case' 0 CA--C 1.506 -0.738 0 CA-C-N 115.373 -0.83 . . . . 0.0 109.29 172.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -60.01 -34.06 72.83 Favored 'General case' 0 C--O 1.21 -1.002 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 175.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 57.0 mt -76.45 -39.92 34.07 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.052 0 C-N-CA 124.123 0.969 . . . . 0.0 109.015 178.679 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . 0.613 ' OD2' ' HA ' ' A' ' 554' ' ' ASN . 20.1 m-20 -54.82 -54.15 46.02 Favored 'General case' 0 N--CA 1.499 2.01 0 CA-C-O 121.759 0.79 . . . . 0.0 108.908 174.444 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 22.2 t70 -56.21 -50.66 70.62 Favored 'General case' 0 C--N 1.324 -0.537 0 CA-C-N 113.538 -1.665 . . . . 0.0 109.564 179.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . 0.619 ' O ' HG12 ' A' ' 563' ' ' ILE . 52.5 t80 -56.14 -55.07 37.57 Favored 'General case' 0 C--N 1.319 -0.748 0 C-N-CA 124.721 1.208 . . . . 0.0 111.304 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 75.6 t -64.97 -37.26 79.79 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.074 0 CA-C-N 116.294 -0.412 . . . . 0.0 111.032 -174.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.4 ' O ' ' HB3' ' A' ' 565' ' ' GLU . 4.1 t-20 -61.43 -41.04 96.55 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 176.125 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . 0.597 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 78.1 t -72.46 -40.47 63.77 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.65 0 C-N-CA 123.859 0.864 . . . . 0.0 113.175 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.619 HG12 ' O ' ' A' ' 559' ' ' TYR . 28.5 mm -89.02 -49.02 14.41 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.906 0 CA-C-O 122.03 0.919 . . . . 0.0 109.519 -170.031 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 11.4 t30 -77.49 3.5 13.32 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 114.591 -1.186 . . . . 0.0 110.559 -175.99 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.597 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 6.0 pt-20 -75.47 -23.18 56.82 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 106.95 -1.5 . . . . 0.0 106.95 174.742 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 87.8 tttt -84.27 7.37 19.44 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-N 114.762 -1.108 . . . . 0.0 109.421 178.236 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -79.69 63.69 3.97 Favored Glycine 0 N--CA 1.445 -0.753 0 N-CA-C 109.707 -1.357 . . . . 0.0 109.707 175.952 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 84.0 mt-30 -75.36 36.68 0.12 Allowed 'General case' 0 C--N 1.314 -0.975 0 C-N-CA 126.369 1.868 . . . . 0.0 111.58 -175.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 27.0 mt-10 -82.09 -71.67 0.47 Allowed 'General case' 0 C--N 1.305 -1.345 0 N-CA-C 107.316 -1.364 . . . . 0.0 107.316 179.683 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -163.37 156.78 19.24 Favored 'General case' 0 C--O 1.252 1.201 0 CA-C-N 115.306 -0.861 . . . . 0.0 110.106 177.279 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 28.2 mm -45.7 -52.51 2.58 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.856 0 O-C-N 125.056 1.473 . . . . 0.0 110.451 179.156 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -68.77 -30.59 69.22 Favored 'General case' 0 N--CA 1.415 -2.219 0 N-CA-C 113.858 1.059 . . . . 0.0 113.858 -173.566 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 14.8 m -68.69 -42.98 77.04 Favored 'General case' 0 C--N 1.325 -0.482 0 N-CA-C 107.209 -1.404 . . . . 0.0 107.209 179.466 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.527 ' O ' ' HG ' ' A' ' 578' ' ' LEU . 0.7 OUTLIER -58.76 -49.09 78.93 Favored 'General case' 0 N--CA 1.426 -1.645 0 CA-C-N 112.983 -1.917 . . . . 0.0 109.296 175.862 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 44.8 t30 -58.72 -55.43 35.25 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.209 1.004 . . . . 0.0 111.464 178.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 50.5 m-70 -55.27 -47.07 76.03 Favored 'General case' 0 CA--C 1.498 -1.04 0 O-C-N 123.736 0.648 . . . . 0.0 111.363 -178.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 50.9 mtmt -65.02 -47.56 77.04 Favored 'General case' 0 N--CA 1.43 -1.475 0 N-CA-C 112.759 0.651 . . . . 0.0 112.759 179.837 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.527 ' HG ' ' O ' ' A' ' 574' ' ' LEU . 91.2 mt -61.04 -62.68 1.68 Allowed 'General case' 0 C--O 1.251 1.178 0 CA-C-O 122.28 1.038 . . . . 0.0 111.004 -178.534 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . . . . . . . . . 27.4 ttt180 -59.74 -56.53 20.62 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-N 113.663 -1.608 . . . . 0.0 113.128 -173.587 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . 0.568 ' O ' ' HG2' ' A' ' 583' ' ' ARG . 28.0 mt-10 -74.64 -35.32 62.87 Favored 'General case' 0 C--N 1.309 -1.159 0 N-CA-C 112.986 0.735 . . . . 0.0 112.986 -170.974 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -63.38 -45.75 89.66 Favored 'General case' 0 C--N 1.322 -0.613 0 C-N-CA 119.994 -0.682 . . . . 0.0 110.896 177.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . . . . . . . . . 4.0 m -71.15 -25.68 62.66 Favored 'General case' 0 C--N 1.315 -0.921 0 CA-C-N 115.325 -0.852 . . . . 0.0 113.022 -178.321 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.568 ' HG2' ' O ' ' A' ' 580' ' ' GLU . 18.5 ptt180 -48.44 -16.79 0.12 Allowed 'General case' 0 N--CA 1.498 1.926 0 N-CA-C 115.262 1.579 . . . . 0.0 115.262 -174.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 44.1 pt -78.93 34.33 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.556 1.195 0 CA-C-O 121.757 0.789 . . . . 0.0 110.945 177.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 129.7 56.68 0.1 Allowed Glycine 0 CA--C 1.493 -1.32 0 N-CA-C 108.777 -1.729 . . . . 0.0 108.777 -178.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . 0.555 ' C ' ' H ' ' A' ' 588' ' ' GLU . 23.2 t0 -87.45 142.28 27.99 Favored 'General case' 0 C--N 1.307 -1.249 0 CA-C-O 122.203 1.002 . . . . 0.0 113.228 -173.21 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 6.7 t -68.38 22.54 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.545 0 C-N-CA 129.874 3.269 . . . . 0.0 109.591 173.824 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.675 ' O ' ' HB2' ' A' ' 592' ' ' TYR . 9.2 pt-20 -39.8 -10.73 0.01 OUTLIER 'General case' 0 C--O 1.199 -1.594 0 C-N-CA 130.786 3.634 . . . . 0.0 117.596 -166.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 68.0 tp -74.4 -60.88 2.07 Favored 'General case' 0 C--N 1.268 -2.977 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 34.5 tt0 -55.9 -47.95 76.52 Favored 'General case' 0 CA--C 1.517 -0.315 0 C-N-CA 124.846 1.258 . . . . 0.0 109.417 173.12 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.586 ' HB3' ' HA ' ' A' ' 588' ' ' GLU . 0.0 OUTLIER -69.13 -27.8 65.89 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 114.995 -1.002 . . . . 0.0 110.528 -175.44 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.675 ' HB2' ' O ' ' A' ' 588' ' ' GLU . 28.8 t80 -61.52 -44.39 97.15 Favored 'General case' 0 CA--C 1.494 -1.178 0 N-CA-C 108.294 -1.002 . . . . 0.0 108.294 177.586 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -57.17 -50.19 73.6 Favored 'General case' 0 C--O 1.238 0.461 0 O-C-N 123.888 0.743 . . . . 0.0 110.741 178.621 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 32.3 tp -59.38 -48.88 79.97 Favored 'General case' 0 C--N 1.321 -0.642 0 CA-C-O 121.436 0.636 . . . . 0.0 110.113 178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -63.4 -35.57 80.85 Favored 'General case' 0 C--N 1.314 -0.951 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.247 -177.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -64.68 -41.76 95.83 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 123.747 0.819 . . . . 0.0 109.388 178.27 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 82.9 mt -57.15 -52.15 59.96 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 CA-C-O 121.661 0.743 . . . . 0.0 109.218 173.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 77.7 t -63.17 -33.25 59.84 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.706 0 CA-C-N 114.615 -1.175 . . . . 0.0 111.39 -178.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.526 ' HA ' ' HD3' ' A' ' 602' ' ' LYS . . . -59.7 -46.44 89.08 Favored 'General case' 0 CA--C 1.502 -0.903 0 CA-C-O 121.239 0.542 . . . . 0.0 110.086 179.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . 0.483 ' O ' ' HB2' ' A' ' 604' ' ' ARG . 62.5 mttp -68.85 -31.89 71.17 Favored 'General case' 0 C--O 1.206 -1.219 0 CA-C-N 115.428 -0.805 . . . . 0.0 111.567 177.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 71.4 m-20 -68.68 -33.59 74.24 Favored 'General case' 0 C--N 1.319 -0.743 0 C-N-CA 120.739 -0.385 . . . . 0.0 111.014 177.354 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.526 ' HD3' ' HA ' ' A' ' 599' ' ' ALA . 8.3 mtpm? -65.94 -62.69 1.36 Allowed 'General case' 0 CA--C 1.49 -1.347 0 CA-C-O 123.102 1.429 . . . . 0.0 108.693 175.308 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 31.8 mt-10 -76.32 1.35 16.4 Favored 'General case' 0 N--CA 1.408 -2.552 0 CA-C-N 112.205 -2.271 . . . . 0.0 113.614 -169.742 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . 0.483 ' HB2' ' O ' ' A' ' 600' ' ' LYS . 15.7 ttm180 -67.58 -30.21 69.77 Favored 'General case' 0 N--CA 1.456 -0.139 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 175.027 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 71.6 mtm . . . . . 0 N--CA 1.435 -1.213 0 CA-C-N 115.223 -0.899 . . . . 0.0 108.818 179.749 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -78.8 166.04 22.89 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 108.918 -0.771 . . . . 0.0 108.918 170.741 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -125.93 69.48 1.2 Allowed 'General case' 0 CA--C 1.491 -1.304 0 CA-C-O 121.647 0.737 . . . . 0.0 110.28 -179.066 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . 0.406 HD13 HH22 ' A' ' 474' ' ' ARG . 65.6 mt -72.53 124.01 24.33 Favored 'General case' 0 C--N 1.298 -1.661 0 CA-C-N 114.369 -1.287 . . . . 0.0 110.384 178.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 27.3 p -86.84 160.25 18.81 Favored 'General case' 0 C--N 1.292 -1.902 0 CA-C-N 116.036 -0.529 . . . . 0.0 110.994 -177.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 13.5 ptp180 -64.11 -29.17 70.31 Favored 'General case' 0 C--N 1.321 -0.665 0 CA-C-N 115.778 -0.646 . . . . 0.0 110.305 178.12 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 24.0 mp0 -66.79 -44.43 81.33 Favored 'General case' 0 C--O 1.19 -2.029 0 O-C-N 123.293 0.37 . . . . 0.0 110.32 179.665 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.572 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 1.1 tm-20 -62.65 -28.67 70.08 Favored 'General case' 0 CA--C 1.551 1.009 0 CA-C-O 121.348 0.594 . . . . 0.0 109.639 -178.038 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.566 ' O ' ' HD3' ' A' ' 471' ' ' LYS . 0.9 OUTLIER -71.2 -35.54 71.6 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 108.922 -0.77 . . . . 0.0 108.922 175.033 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -60.52 -48.94 79.56 Favored 'General case' 0 CA--C 1.513 -0.473 0 N-CA-C 110.048 -0.353 . . . . 0.0 110.048 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . 0.566 ' HB3' ' CD2' ' A' ' 504' ' ' PHE . 1.7 mp0 -58.54 -39.93 81.59 Favored 'General case' 0 CA--C 1.551 0.995 0 CA-C-O 121.146 0.498 . . . . 0.0 110.722 175.911 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.572 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 93.8 mtt180 -62.23 -35.34 78.61 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-N 116.485 -0.325 . . . . 0.0 110.22 176.87 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -66.26 -38.12 87.1 Favored 'General case' 0 C--O 1.219 -0.54 0 CA-C-N 116.413 -0.358 . . . . 0.0 110.651 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . 0.485 ' O ' HD12 ' A' ' 480' ' ' LEU . 1.3 m-85 -65.83 -26.73 67.8 Favored 'General case' 0 C--N 1.315 -0.928 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 174.285 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 95.1 mt -82.66 -17.08 45.83 Favored 'General case' 0 C--N 1.313 -1.003 0 N-CA-C 112.251 0.463 . . . . 0.0 112.251 175.324 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 34.1 ttpt -40.95 -65.13 0.46 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 115.261 1.578 . . . . 0.0 115.261 -168.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.485 ' HA ' ' SD ' ' A' ' 481' ' ' MET . 5.7 t-80 -147.57 36.68 0.89 Allowed 'General case' 0 C--N 1.305 -1.331 0 C-N-CA 119.131 -1.028 . . . . 0.0 108.869 -174.046 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.495 HD13 HG21 ' A' ' 486' ' ' THR . 84.0 mt -115.89 29.57 7.9 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.222 -174.467 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . 0.485 ' SD ' ' HA ' ' A' ' 479' ' ' HIS . 2.1 mpp? -76.07 -38.31 57.2 Favored 'General case' 0 N--CA 1.472 0.658 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.759 -176.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 83.4 mtp180 -67.82 -48.2 66.89 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-O 121.912 0.863 . . . . 0.0 110.126 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . 0.432 9.0 p-10 -74.51 60.49 0.88 Allowed 'General case' 0 C--N 1.288 -2.108 0 N-CA-C 115.647 1.721 . . . . 0.0 115.647 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . 0.489 ' HB2' ' CE2' ' A' ' 515' ' ' TYR . 19.5 ptpt -40.83 -30.97 0.14 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 127.144 2.178 . . . . 0.0 112.858 178.612 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -52.17 -50.19 62.3 Favored 'General case' 0 CA--C 1.504 -0.804 0 C-N-CA 124.796 1.238 . . . . 0.0 108.94 176.292 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.495 HG21 HD13 ' A' ' 480' ' ' LEU . 31.6 m -64.28 -35.88 82.27 Favored 'General case' 0 N--CA 1.428 -1.555 0 C-N-CA 125.324 1.45 . . . . 0.0 111.968 -177.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 19.7 t80 -59.32 -53.13 61.7 Favored 'General case' 0 C--O 1.258 1.506 0 CA-C-O 121.76 0.79 . . . . 0.0 109.151 177.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.515 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 4.0 mm? -72.2 -25.06 61.52 Favored 'General case' 0 C--O 1.202 -1.4 0 CA-C-N 115.712 -0.676 . . . . 0.0 110.908 178.468 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.4 t-20 -65.26 -33.15 75.3 Favored 'General case' 0 CA--C 1.504 -0.797 0 O-C-N 122.982 0.176 . . . . 0.0 110.604 -179.423 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -79.79 -33.95 40.07 Favored 'General case' 0 N--CA 1.385 -3.679 0 N-CA-C 108.474 -0.936 . . . . 0.0 108.474 179.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 60.1 m-85 -66.47 -27.33 67.72 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 120.1 -0.64 . . . . 0.0 112.4 173.145 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . 0.515 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 14.4 mm-40 -78.51 -28.28 46.25 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.083 0.468 . . . . 0.0 110.967 175.573 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 51.0 m -85.09 -49.54 8.18 Favored 'General case' 0 C--N 1.307 -1.278 0 CA-C-O 121.601 0.715 . . . . 0.0 110.986 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.2 t -135.96 100.23 2.39 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.526 0 CA-C-N 115.736 -0.665 . . . . 0.0 109.523 -176.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . 0.426 ' C ' ' H ' ' A' ' 497' ' ' ASP . 6.0 p-10 -95.19 14.91 20.61 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-O 122.405 1.097 . . . . 0.0 109.171 174.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 92.9 mttt -84.64 21.76 1.45 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 127.073 2.149 . . . . 0.0 109.42 178.152 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . 0.426 ' H ' ' C ' ' A' ' 495' ' ' ASP . 9.7 t70 -53.16 -1.44 0.02 OUTLIER 'General case' 0 CA--C 1.563 1.46 0 C-N-CA 128.991 2.916 . . . . 0.0 114.709 -176.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 30.7 p-10 -73.88 -0.99 17.69 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 120.686 -1.259 . . . . 0.0 112.033 -175.463 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -83.46 -18.84 37.2 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 116.201 -0.454 . . . . 0.0 110.897 177.446 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . 0.459 ' HB ' ' HB3' ' A' ' 504' ' ' PHE . 23.4 p -60.87 158.23 13.55 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 116.36 1.985 . . . . 0.0 116.36 -172.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 25.4 t-20 -91.8 167.31 12.25 Favored 'General case' 0 N--CA 1.439 -1.008 0 CA-C-N 114.895 -1.048 . . . . 0.0 108.533 175.202 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -59.84 -24.32 64.11 Favored 'General case' 0 N--CA 1.476 0.869 0 CA-C-N 118.453 0.57 . . . . 0.0 110.054 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 9.4 m-70 -54.79 -53.65 52.41 Favored 'General case' 0 N--CA 1.455 -0.199 0 N-CA-C 108.728 -0.841 . . . . 0.0 108.728 175.873 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . 0.566 ' CD2' ' HB3' ' A' ' 473' ' ' GLU . 10.6 t80 -64.4 -40.02 94.98 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.415 -179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 31.2 ttpt -57.67 -47.2 82.97 Favored 'General case' 0 CA--C 1.49 -1.344 0 O-C-N 123.943 0.777 . . . . 0.0 109.25 -176.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.616 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -60.77 -45.53 93.99 Favored 'General case' 0 N--CA 1.42 -1.962 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.135 -179.176 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 45.9 t -62.8 -48.55 87.58 Favored 'Isoleucine or valine' 0 C--O 1.241 0.611 0 C-N-CA 120.385 -0.526 . . . . 0.0 110.221 179.437 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 17.8 t80 -49.54 -49.78 44.68 Favored 'General case' 0 N--CA 1.476 0.839 0 O-C-N 123.951 0.782 . . . . 0.0 110.654 174.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 42.2 tt0 -58.22 -55.84 29.74 Favored 'General case' 0 N--CA 1.443 -0.813 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.946 -177.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.616 HG23 ' O ' ' A' ' 506' ' ' TYR . 12.1 t -57.69 -52.03 62.64 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.369 0 N-CA-C 109.708 -0.479 . . . . 0.0 109.708 -178.998 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.512 ' O ' ' HB2' ' A' ' 515' ' ' TYR . 88.9 mt -56.31 -53.05 61.88 Favored 'General case' 0 C--O 1.213 -0.859 0 O-C-N 123.819 0.699 . . . . 0.0 111.421 -176.434 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 16.2 t60 -61.64 -38.49 87.87 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 123.519 0.728 . . . . 0.0 110.588 -177.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -67.49 -52.27 41.22 Favored 'General case' 0 C--N 1.312 -1.04 0 CA-C-N 115.904 -0.589 . . . . 0.0 112.451 -176.515 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . 0.264 5.0 p90 -73.71 -31.11 63.24 Favored 'General case' 0 C--O 1.192 -1.936 0 C-N-CA 119.008 -1.077 . . . . 0.0 111.985 -178.981 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . 0.512 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 0.4 OUTLIER -55.67 -41.54 73.8 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 177.811 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -67.18 -18.69 65.37 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 115.151 -0.932 . . . . 0.0 112.497 -178.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -115.67 -44.8 2.93 Favored 'General case' 0 C--N 1.317 -0.827 0 C-N-CA 119.948 -0.701 . . . . 0.0 112.168 -178.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . 0.427 ' HB3' ' H ' ' A' ' 519' ' ' ASP . 15.0 m120 -125.59 -151.79 0.49 Allowed 'General case' 0 C--N 1.301 -1.526 0 C-N-CA 124.852 1.261 . . . . 0.0 111.391 -168.741 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . 0.427 ' H ' ' HB3' ' A' ' 518' ' ' ASN . 6.1 p-10 -105.51 -157.49 0.62 Allowed 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 127.047 2.139 . . . . 0.0 110.456 -173.738 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 36.7 mt-30 -60.51 177.68 0.27 Allowed 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 125.834 1.654 . . . . 0.0 113.876 -170.914 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 63.7 t80 -90.29 146.92 23.84 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 125.87 1.668 . . . . 0.0 109.085 -178.471 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -118.58 155.33 31.12 Favored 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.267 -1.012 . . . . 0.0 108.267 176.33 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 50.1 pt -64.0 -21.87 29.79 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 O-C-N 122.249 -0.282 . . . . 0.0 111.567 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 22.7 t -57.66 -34.87 69.82 Favored 'General case' 0 N--CA 1.451 -0.376 0 N-CA-C 109.787 -0.449 . . . . 0.0 109.787 174.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 11.5 m-20 -63.71 -50.32 69.65 Favored 'General case' 0 C--N 1.349 0.549 0 N-CA-C 108.552 -0.907 . . . . 0.0 108.552 177.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -59.0 -44.37 91.66 Favored 'General case' 0 N--CA 1.476 0.845 0 CA-C-O 121.594 0.712 . . . . 0.0 110.857 -179.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.502 ' O ' HG22 ' A' ' 530' ' ' VAL . 55.8 t -65.1 -37.46 80.26 Favored 'Isoleucine or valine' 0 N--CA 1.428 -1.531 0 C-N-CA 124.052 0.941 . . . . 0.0 111.912 178.749 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -70.21 -16.85 63.11 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 117.95 -1.5 . . . . 0.0 110.213 175.644 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 51.8 m-85 -80.59 6.42 12.65 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 113.248 0.832 . . . . 0.0 113.248 172.89 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.502 HG22 ' O ' ' A' ' 527' ' ' VAL . 26.9 m -74.34 10.63 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 C-N-CA 119.934 -0.706 . . . . 0.0 111.514 173.559 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -99.12 -15.02 19.13 Favored 'General case' 0 C--N 1.295 -1.784 0 CA-C-N 115.324 -0.853 . . . . 0.0 108.943 177.24 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . 0.478 ' HB2' ' HB2' ' A' ' 535' ' ' LEU . 27.1 m -88.69 156.2 19.14 Favored 'General case' 0 N--CA 1.438 -1.057 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 176.776 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 63.6 t30 -63.18 -75.01 0.08 Allowed 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 114.15 1.167 . . . . 0.0 114.15 -173.198 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 19.3 mp0 -86.4 -28.55 23.51 Favored 'General case' 0 CA--C 1.504 -0.793 0 CA-C-O 121.399 0.619 . . . . 0.0 110.257 -173.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.478 ' HB2' ' HB2' ' A' ' 532' ' ' SER . 58.3 mt -62.08 -32.95 73.55 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.942 -174.56 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -53.84 -63.43 1.15 Allowed 'General case' 0 C--O 1.255 1.37 0 O-C-N 124.293 0.996 . . . . 0.0 109.675 176.224 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -63.26 -55.72 22.52 Favored 'General case' 0 N--CA 1.43 -1.455 0 CA-C-N 114.17 -1.377 . . . . 0.0 111.359 -176.108 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.421 ' O ' HD13 ' A' ' 542' ' ' LEU . 23.4 m -58.83 -53.81 54.21 Favored 'General case' 0 N--CA 1.434 -1.232 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -174.752 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . 0.422 HD13 ' HA ' ' A' ' 539' ' ' LEU 0.299 4.0 mm? -63.88 -40.4 96.45 Favored 'General case' 0 CA--C 1.509 -0.612 0 N-CA-C 114.674 1.361 . . . . 0.0 114.674 -176.493 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 58.6 mt -68.85 -34.91 66.92 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 C-N-CA 118.637 -1.225 . . . . 0.0 109.774 176.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 34.6 t -56.76 -48.91 76.76 Favored 'General case' 0 CA--C 1.547 0.828 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 174.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.5 ' HA ' ' CE2' ' A' ' 545' ' ' TYR . 6.6 mp -64.7 -32.22 73.8 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 124.671 1.188 . . . . 0.0 112.454 179.714 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.59 -54.83 7.26 Favored 'General case' 0 C--N 1.305 -1.347 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 178.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . 0.551 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 46.9 tt0 -74.64 35.08 0.1 Allowed 'General case' 0 CA--C 1.564 1.489 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -173.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . 0.5 ' CE2' ' HA ' ' A' ' 542' ' ' LEU . 16.6 m-85 -77.28 166.35 23.29 Favored 'General case' 0 C--N 1.265 -3.105 0 O-C-N 120.491 -1.38 . . . . 0.0 110.882 170.498 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 45.4 m-80 -93.5 117.85 30.59 Favored 'General case' 0 C--N 1.302 -1.487 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 -179.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 92.8 mt -74.43 -16.27 60.88 Favored 'General case' 0 C--N 1.315 -0.912 0 CA-C-N 115.876 -0.602 . . . . 0.0 112.199 -176.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 19.5 m120 -70.5 -43.07 70.44 Favored 'General case' 0 CA--C 1.51 -0.589 0 C-N-CA 120.559 -0.456 . . . . 0.0 109.838 177.391 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . 0.467 ' C ' ' HD3' ' A' ' 551' ' ' PRO . 40.6 m-20 -74.81 1.21 13.1 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.424 -179.842 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.406 ' N ' ' HD3' ' A' ' 551' ' ' PRO . 35.6 tt0 -119.59 67.99 10.83 Favored Pre-proline 0 CA--C 1.567 1.623 0 C-N-CA 119.262 -0.975 . . . . 0.0 113.039 -175.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . 0.524 ' HD2' ' H ' ' A' ' 552' ' ' TYR . 72.1 Cg_endo -119.25 -14.7 0.01 OUTLIER 'Trans proline' 0 CA--C 1.579 2.747 0 C-N-CA 122.24 1.96 . . . . 0.0 114.658 168.44 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . 0.524 ' H ' ' HD2' ' A' ' 551' ' ' PRO . 48.7 m-85 -114.15 52.8 0.81 Allowed 'General case' 0 CA--C 1.49 -1.339 0 C-N-CA 124.773 1.229 . . . . 0.0 108.287 -171.206 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . 0.277 7.5 mm-40 -58.84 67.84 0.0 OUTLIER 'General case' 0 C--N 1.297 -1.689 0 N-CA-C 118.622 2.823 . . . . 0.0 118.622 -170.049 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . 0.4 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 9.6 m120 -65.94 -20.95 66.38 Favored 'General case' 0 C--O 1.194 -1.816 0 CA-C-N 113.649 -1.614 . . . . 0.0 108.992 169.22 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -43.91 -41.01 4.95 Favored 'General case' 0 C--O 1.204 -1.294 0 C-N-CA 124.611 1.164 . . . . 0.0 111.519 173.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 62.1 mt -64.17 -45.32 96.7 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.676 0 N-CA-C 109.0 -0.741 . . . . 0.0 109.0 177.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . 0.4 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 13.7 t70 -60.03 -45.49 92.62 Favored 'General case' 0 C--N 1.315 -0.905 0 CA-C-N 116.064 -0.516 . . . . 0.0 110.256 175.677 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . 0.504 ' O ' HG23 ' A' ' 562' ' ' VAL . 18.4 t70 -58.16 -56.34 23.34 Favored 'General case' 0 CA--C 1.503 -0.828 0 C-N-CA 124.404 1.082 . . . . 0.0 109.407 179.136 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -48.03 -53.16 17.21 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 125.28 1.432 . . . . 0.0 110.138 176.169 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 37.2 t -57.69 -50.94 75.84 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.949 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.772 178.075 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -62.04 -31.41 71.82 Favored 'General case' 0 C--O 1.209 -1.034 0 C-N-CA 123.3 0.64 . . . . 0.0 111.677 -179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 558' ' ' ASP . 78.0 t -69.0 -34.71 65.42 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.998 0 CA-C-O 121.329 0.585 . . . . 0.0 111.776 178.088 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . . . . . . . . . 57.3 mt -87.41 -35.67 8.72 Favored 'Isoleucine or valine' 0 C--N 1.284 -2.248 0 N-CA-C 107.58 -1.267 . . . . 0.0 107.58 -177.073 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . 0.493 ' HA ' ' OE1' ' A' ' 572' ' ' GLU . 4.1 t-20 -77.62 2.57 16.22 Favored 'General case' 0 CA--C 1.545 0.757 0 CA-C-N 113.694 -1.594 . . . . 0.0 109.83 176.52 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -71.32 -31.09 67.01 Favored 'General case' 0 C--N 1.31 -1.14 0 N-CA-C 106.026 -1.842 . . . . 0.0 106.026 174.838 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 34.0 mmtp -76.81 5.77 7.21 Favored 'General case' 0 C--N 1.313 -0.991 0 N-CA-C 115.389 1.626 . . . . 0.0 115.389 -174.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . 162.51 145.39 4.32 Favored Glycine 1 N--CA 1.393 -4.226 0 C-N-CA 119.422 -1.37 . . . . 0.0 111.487 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 43.6 mt-30 -138.59 47.53 1.96 Allowed 'General case' 0 C--N 1.262 -3.205 0 N-CA-C 108.315 -0.995 . . . . 0.0 108.315 170.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . 0.524 ' CD ' ' H ' ' A' ' 570' ' ' THR . 0.0 OUTLIER -99.4 -98.28 0.23 Allowed 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 113.941 1.089 . . . . 0.0 113.941 -175.037 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . 0.524 ' H ' ' CD ' ' A' ' 569' ' ' GLU . 15.4 m -108.3 -55.32 2.39 Favored 'General case' 0 N--CA 1.421 -1.906 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 23.2 mt -62.26 -49.64 83.17 Favored 'Isoleucine or valine' 0 CA--C 1.481 -1.706 0 CA-C-O 121.977 0.894 . . . . 0.0 109.385 -173.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . 0.56 ' O ' ' HB3' ' A' ' 575' ' ' ASN . 60.2 mm-40 -67.3 -19.15 65.43 Favored 'General case' 0 N--CA 1.404 -2.774 0 CA-C-N 113.862 -1.517 . . . . 0.0 112.723 -176.225 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 48.8 m -71.28 -38.69 71.81 Favored 'General case' 0 C--O 1.269 2.087 0 O-C-N 121.925 -0.484 . . . . 0.0 110.049 173.721 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.745 ' HA ' ' HE2' ' A' ' 602' ' ' LYS . 7.2 mp -62.11 -38.84 90.44 Favored 'General case' 0 N--CA 1.489 1.496 0 CA-C-O 123.267 1.508 . . . . 0.0 109.419 177.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . 0.625 ' O ' ' HB3' ' A' ' 578' ' ' LEU 0.263 10.2 t30 -60.54 -27.57 67.76 Favored 'General case' 1 C--N 1.235 -4.403 0 CA-C-N 111.781 -2.463 . . . . 0.0 112.016 175.124 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 41.5 m80 -69.81 -34.5 73.79 Favored 'General case' 0 C--N 1.314 -0.952 0 O-C-N 120.788 -1.195 . . . . 0.0 111.266 171.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . 0.499 ' HB3' ' O ' ' A' ' 574' ' ' LEU . 50.0 tptt -60.03 -39.21 85.11 Favored 'General case' 0 CA--C 1.561 1.375 0 CA-C-O 121.9 0.857 . . . . 0.0 109.502 170.439 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.625 ' HB3' ' O ' ' A' ' 575' ' ' ASN . 63.6 tp -55.12 -37.48 66.96 Favored 'General case' 0 C--N 1.308 -1.231 0 CA-C-N 115.544 -0.753 . . . . 0.0 110.591 171.423 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.454 ' HG2' HD23 ' A' ' 594' ' ' LEU . 8.5 tpt180 -62.68 -32.4 73.47 Favored 'General case' 0 C--O 1.245 0.856 0 CA-C-O 121.75 0.786 . . . . 0.0 110.245 175.533 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . 0.455 ' HG3' ' NE2' ' A' ' 595' ' ' GLN . 26.2 tt0 -62.72 -35.63 80.37 Favored 'General case' 0 C--O 1.2 -1.527 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 175.535 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -66.97 -25.97 66.58 Favored 'General case' 0 CA--C 1.569 1.69 0 CA-C-O 121.468 0.651 . . . . 0.0 111.752 171.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.461 ' O ' ' N ' ' A' ' 584' ' ' ILE . 14.6 m -66.7 -23.27 66.1 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 126.311 1.845 . . . . 0.0 111.888 176.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.413 HH21 ' HG2' ' A' ' 580' ' ' GLU . 14.6 ptp180 -33.33 13.56 0.0 OUTLIER 'General case' 0 N--CA 1.536 3.826 0 N-CA-C 118.13 2.641 . . . . 0.0 118.13 173.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.461 ' N ' ' O ' ' A' ' 582' ' ' THR . 33.4 pt -81.78 12.28 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.408 0 C-N-CA 124.675 1.19 . . . . 0.0 110.152 179.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 132.73 57.77 0.08 OUTLIER Glycine 0 CA--C 1.5 -0.892 0 C-N-CA 119.255 -1.45 . . . . 0.0 115.613 171.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . 0.465 ' O ' ' HG3' ' A' ' 591' ' ' LYS . 22.0 p-10 -142.22 58.99 1.47 Allowed 'General case' 0 C--N 1.306 -1.287 0 N-CA-C 104.445 -2.428 . . . . 0.0 104.445 173.27 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.491 ' HA ' ' HE2' ' A' ' 591' ' ' LYS 0.376 8.1 p -64.75 -87.89 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.574 1.874 0 N-CA-C 121.117 3.747 . . . . 0.0 121.117 -162.971 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.575 ' CD ' ' H ' ' A' ' 589' ' ' LEU 0.374 0.0 OUTLIER -65.83 -88.22 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.496 0 N-CA-C 117.594 2.442 . . . . 0.0 117.594 -158.478 . . . . . . . . 4 4 . 1 . 013 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . 0.575 ' H ' ' CD ' ' A' ' 588' ' ' GLU . 7.2 tt -71.8 -33.23 68.37 Favored 'General case' 0 C--N 1.282 -2.367 0 C-N-CA 124.482 1.113 . . . . 0.0 108.388 -175.261 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 28.9 tp60 -54.75 -54.09 46.58 Favored 'General case' 0 N--CA 1.433 -1.318 0 CA-C-N 113.585 -1.643 . . . . 0.0 110.99 -177.302 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.51 ' O ' ' HB3' ' A' ' 595' ' ' GLN . 50.6 mtmt -84.99 -38.24 19.48 Favored 'General case' 0 C--O 1.199 -1.56 0 CA-C-O 118.619 -0.705 . . . . 0.0 112.631 179.255 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 75.0 t80 -50.1 -54.74 18.45 Favored 'General case' 0 N--CA 1.469 0.524 0 O-C-N 123.366 0.416 . . . . 0.0 110.902 -174.063 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . 0.599 ' HA ' HD13 ' A' ' 597' ' ' ILE . 55.7 m-85 -64.99 -60.5 2.97 Favored 'General case' 0 N--CA 1.438 -1.075 0 N-CA-C 112.583 0.586 . . . . 0.0 112.583 177.21 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.454 HD23 ' HG2' ' A' ' 579' ' ' ARG . 2.8 tp -59.65 -53.15 61.33 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-O 122.63 1.205 . . . . 0.0 110.624 -170.416 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.51 ' HB3' ' O ' ' A' ' 591' ' ' LYS . 18.9 tt0 -71.93 -64.37 0.95 Allowed 'General case' 0 C--N 1.286 -2.182 0 CA-C-N 113.684 -1.598 . . . . 0.0 112.414 -174.599 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -60.8 -39.66 89.76 Favored 'General case' 0 C--O 1.246 0.92 0 C-N-CA 119.878 -0.729 . . . . 0.0 111.401 -167.807 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.599 HD13 ' HA ' ' A' ' 593' ' ' TYR . 1.7 mp -61.39 -56.54 17.16 Favored 'Isoleucine or valine' 0 C--O 1.252 1.198 0 O-C-N 123.671 0.607 . . . . 0.0 110.843 176.272 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 23.6 t -78.53 -30.45 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 C-N-CA 118.842 -1.143 . . . . 0.0 113.095 -172.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.438 ' O ' ' HB3' ' A' ' 602' ' ' LYS . . . -63.23 -40.85 98.62 Favored 'General case' 0 C--N 1.318 -0.8 0 C-N-CA 122.637 0.375 . . . . 0.0 110.766 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . 0.407 ' HG2' ' O ' ' A' ' 597' ' ' ILE . 64.7 pttt -66.69 -40.77 88.66 Favored 'General case' 0 N--CA 1.439 -1.017 0 C-N-CA 119.317 -0.953 . . . . 0.0 109.29 176.314 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . 0.565 ' O ' ' HG2' ' A' ' 605' ' ' MET . 66.8 t30 -66.81 -30.68 70.93 Favored 'General case' 0 C--O 1.213 -0.819 0 CA-C-O 120.81 0.338 . . . . 0.0 110.848 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.745 ' HE2' ' HA ' ' A' ' 574' ' ' LEU . 31.7 tttm -60.19 -51.96 67.37 Favored 'General case' 0 CA--C 1.5 -0.976 0 C-N-CA 124.134 0.974 . . . . 0.0 108.909 178.166 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -68.96 -39.17 79.64 Favored 'General case' 0 N--CA 1.417 -2.078 0 CA-C-N 113.913 -1.494 . . . . 0.0 109.712 -177.452 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 97.3 mtt180 -78.31 14.04 1.34 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . 0.565 ' HG2' ' O ' ' A' ' 601' ' ' ASN . 85.0 mmm . . . . . 0 CA--C 1.502 -0.883 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 174.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 . . . . . 0 N--CA 1.441 -0.879 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 73.9 m-20 -80.44 119.15 22.75 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 177.378 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 65.9 t30 -90.38 50.33 1.82 Allowed 'General case' 0 C--N 1.304 -1.405 0 CA-C-O 122.503 1.144 . . . . 0.0 109.099 -173.705 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 96.5 mt -60.47 125.04 22.18 Favored 'General case' 0 N--CA 1.431 -1.388 0 CA-C-N 114.0 -1.455 . . . . 0.0 110.616 -179.255 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 15.0 m -95.16 150.34 20.31 Favored 'General case' 0 N--CA 1.422 -1.83 0 CA-C-N 115.507 -0.769 . . . . 0.0 109.891 -177.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . 0.469 ' O ' ' HB3' ' A' ' 471' ' ' LYS . 19.9 tpp180 -60.98 -20.38 62.32 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.621 1.169 . . . . 0.0 110.712 -178.771 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.714 HE21 ' N ' ' A' ' 469' ' ' GLN . 0.0 OUTLIER -58.99 -40.57 85.25 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.642 177.971 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 34.2 tt0 -67.03 -30.81 71.0 Favored 'General case' 0 C--O 1.203 -1.345 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.425 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.469 ' HB3' ' O ' ' A' ' 468' ' ' ARG . 27.1 tptp -62.48 -37.93 87.88 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-N 115.961 -0.563 . . . . 0.0 110.904 179.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -64.44 -45.43 87.53 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-O 121.559 0.695 . . . . 0.0 109.239 175.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -61.94 -33.46 74.31 Favored 'General case' 0 C--N 1.309 -1.17 0 CA-C-N 115.04 -0.982 . . . . 0.0 111.745 177.542 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.582 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 98.9 mtt180 -65.92 -36.8 84.37 Favored 'General case' 0 C--O 1.214 -0.783 0 C-N-CA 122.459 0.304 . . . . 0.0 110.524 175.118 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -65.9 -45.5 81.75 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.307 0.575 . . . . 0.0 109.954 178.801 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -61.28 -27.78 68.71 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 122.031 0.919 . . . . 0.0 111.173 175.821 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.48 ' HB3' ' O ' ' A' ' 474' ' ' ARG . 61.8 tp -77.22 -14.83 59.7 Favored 'General case' 0 C--N 1.31 -1.139 0 C-N-CA 126.004 1.722 . . . . 0.0 113.557 -175.314 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 24.8 ttpp -41.12 -50.26 3.46 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 124.312 1.045 . . . . 0.0 110.833 -173.204 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 4.4 p-80 -168.2 128.23 1.28 Allowed 'General case' 0 CA--C 1.48 -1.73 0 N-CA-C 107.311 -1.366 . . . . 0.0 107.311 166.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.515 ' HG ' ' OD2' ' A' ' 519' ' ' ASP . 0.8 OUTLIER -58.48 119.49 7.09 Favored 'General case' 0 C--O 1.251 1.145 0 N-CA-C 107.496 -1.298 . . . . 0.0 107.496 -179.599 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 72.8 mtm -93.21 -53.57 4.05 Favored 'General case' 0 N--CA 1.424 -1.759 0 N-CA-C 115.343 1.608 . . . . 0.0 115.343 -172.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . 0.641 ' HB2' ' OG1' ' A' ' 486' ' ' THR 0.255 36.4 mmt180 -76.33 -99.05 0.02 OUTLIER 'General case' 0 C--O 1.212 -0.875 0 C-N-CA 116.379 -2.129 . . . . 0.0 114.409 -174.263 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . 0.644 ' OD2' ' HG3' ' A' ' 484' ' ' LYS . 25.4 t70 -145.72 -86.89 0.11 Allowed 'General case' 0 C--O 1.196 -1.726 0 C-N-CA 115.639 -2.424 . . . . 0.0 116.819 170.157 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . 0.644 ' HG3' ' OD2' ' A' ' 483' ' ' ASP . 61.8 mttp -97.54 -52.33 3.82 Favored 'General case' 0 C--N 1.303 -1.452 0 CA-C-N 114.669 -1.15 . . . . 0.0 113.464 -178.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 17.6 t70 -56.45 -42.75 78.69 Favored 'General case' 0 CA--C 1.497 -1.085 0 CA-C-N 114.745 -1.116 . . . . 0.0 109.88 -178.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.641 ' OG1' ' HB2' ' A' ' 482' ' ' ARG . 42.2 m -61.51 -37.57 84.2 Favored 'General case' 0 CA--C 1.551 0.982 0 CA-C-N 116.041 -0.527 . . . . 0.0 111.975 -177.705 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 35.6 t80 -62.62 -54.12 44.32 Favored 'General case' 0 C--N 1.318 -0.788 0 CA-C-N 116.114 -0.494 . . . . 0.0 110.658 177.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 77.5 mt -66.8 -28.46 68.4 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 110.005 -0.369 . . . . 0.0 110.005 -179.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -61.49 -40.97 96.5 Favored 'General case' 0 CA--C 1.509 -0.605 0 C-N-CA 123.765 0.826 . . . . 0.0 110.659 -179.18 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -92.51 -37.15 12.67 Favored 'General case' 0 N--CA 1.399 -3.02 0 C-N-CA 120.486 -0.485 . . . . 0.0 110.732 178.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 70.5 t80 -79.95 -59.65 2.64 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 114.704 1.372 . . . . 0.0 114.704 -175.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -78.82 -7.4 57.83 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-O 121.839 0.828 . . . . 0.0 111.751 -166.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 18.2 m -75.51 -6.8 52.04 Favored 'General case' 0 C--N 1.302 -1.492 0 CA-C-N 115.32 -0.854 . . . . 0.0 111.469 177.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 46.0 t -100.27 99.22 8.05 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.502 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 176.466 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -97.45 -82.84 0.41 Allowed 'General case' 0 C--N 1.313 -1.002 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -178.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 29.3 mmmt -83.17 -26.88 30.49 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 121.575 0.702 . . . . 0.0 110.876 -179.823 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . 0.408 ' C ' ' H ' ' A' ' 499' ' ' PHE . 38.0 t70 -77.56 31.09 0.15 Allowed 'General case' 0 C--N 1.303 -1.424 0 C-N-CA 125.574 1.55 . . . . 0.0 110.914 -178.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 3.9 p-10 -72.93 33.53 0.07 Allowed 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.688 1.195 . . . . 0.0 111.78 -177.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . 0.408 ' H ' ' C ' ' A' ' 497' ' ' ASP . 15.1 p90 -73.52 -13.81 61.11 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 116.025 -0.534 . . . . 0.0 110.055 -179.719 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -60.84 150.78 31.78 Favored 'General case' 0 N--CA 1.431 -1.397 0 N-CA-C 113.284 0.846 . . . . 0.0 113.284 -178.398 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 26.1 t-20 -74.72 163.81 27.28 Favored 'General case' 0 C--N 1.301 -1.517 0 CA-C-N 114.801 -1.091 . . . . 0.0 112.052 -172.158 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . 0.47 ' O ' ' HB3' ' A' ' 505' ' ' LYS . 8.7 tt0 -56.18 -5.22 0.17 Allowed 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 126.438 1.895 . . . . 0.0 111.839 177.723 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 33.7 m170 -52.6 -45.17 66.43 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 108.162 -1.051 . . . . 0.0 108.162 172.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 8.0 m-85 -60.84 -30.31 70.03 Favored 'General case' 0 C--O 1.204 -1.301 0 CA-C-N 115.406 -0.816 . . . . 0.0 112.646 175.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . 0.47 ' HB3' ' O ' ' A' ' 502' ' ' GLN . 22.1 tptm -70.35 -47.75 59.54 Favored 'General case' 0 C--N 1.313 -0.984 0 C-N-CA 123.241 0.617 . . . . 0.0 110.332 -175.415 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.517 ' O ' HG23 ' A' ' 510' ' ' VAL . 96.9 m-85 -59.63 -46.8 87.92 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 178.897 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . 0.413 ' CG2' HD11 ' A' ' 477' ' ' LEU . 71.1 t -58.25 -57.49 10.55 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 114.227 -1.351 . . . . 0.0 111.263 178.134 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -48.41 -45.59 36.32 Favored 'General case' 0 C--O 1.212 -0.885 0 O-C-N 124.047 0.842 . . . . 0.0 112.349 -179.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -61.3 -53.77 52.46 Favored 'General case' 0 C--N 1.311 -1.094 0 CA-C-O 121.048 0.452 . . . . 0.0 110.491 -179.348 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.517 HG23 ' O ' ' A' ' 506' ' ' TYR . 24.5 t -60.85 -51.35 74.22 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 CA-C-O 121.368 0.604 . . . . 0.0 111.097 -178.63 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 10.4 mp -66.91 -34.05 76.92 Favored 'General case' 0 C--O 1.2 -1.546 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.482 -175.707 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -65.85 -29.53 70.0 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-O 120.99 0.424 . . . . 0.0 110.548 176.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 13.9 t70 -68.12 -37.05 80.7 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 176.359 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . 0.405 ' HB3' ' HA ' ' A' ' 519' ' ' ASP . 28.9 m-85 -76.46 -46.16 28.1 Favored 'General case' 0 C--O 1.2 -1.551 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.324 178.738 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -46.21 -32.83 3.24 Favored 'General case' 0 N--CA 1.485 1.288 0 C-N-CA 125.901 1.68 . . . . 0.0 111.129 176.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -57.55 -29.8 64.69 Favored 'General case' 0 N--CA 1.451 -0.421 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.783 178.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.508 ' HG3' HD22 ' A' ' 518' ' ' ASN . 11.5 tp10 -119.77 -59.73 1.78 Allowed 'General case' 0 CA--C 1.557 1.222 0 C-N-CA 119.874 -0.73 . . . . 0.0 110.016 175.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . 0.508 HD22 ' HG3' ' A' ' 517' ' ' GLU . 6.5 p30 -158.31 124.32 4.61 Favored 'General case' 0 C--N 1.307 -1.259 0 N-CA-C 107.98 -1.119 . . . . 0.0 107.98 176.109 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . 0.515 ' OD2' ' HG ' ' A' ' 480' ' ' LEU . 24.3 t0 -95.4 96.75 9.32 Favored 'General case' 0 CA--C 1.484 -1.572 0 C-N-CA 117.274 -1.77 . . . . 0.0 110.468 179.616 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 482' ' ' ARG . 88.5 mt-30 -137.86 77.1 1.61 Allowed 'General case' 0 C--N 1.274 -2.7 0 N-CA-C 105.949 -1.871 . . . . 0.0 105.949 178.196 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 20.2 t80 -46.53 121.05 3.21 Favored 'General case' 0 N--CA 1.427 -1.588 0 C-N-CA 126.093 1.757 . . . . 0.0 113.039 -174.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 9.8 p30 -91.02 167.13 12.61 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 115.137 -0.938 . . . . 0.0 108.602 178.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 44.7 pt -87.07 -17.37 8.86 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 C-N-CA 120.166 -0.614 . . . . 0.0 112.132 -177.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 23.0 t -60.16 -46.17 90.6 Favored 'General case' 0 CA--C 1.541 0.609 0 N-CA-C 110.23 -0.285 . . . . 0.0 110.23 179.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -62.19 -38.04 87.6 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 116.619 -0.264 . . . . 0.0 110.676 176.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -60.37 -48.03 83.53 Favored 'General case' 0 C--O 1.217 -0.656 0 CA-C-O 120.998 0.428 . . . . 0.0 110.409 176.422 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.518 ' O ' HG22 ' A' ' 530' ' ' VAL . 97.5 t -64.98 -30.71 51.19 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.884 0 C-N-CA 123.719 0.807 . . . . 0.0 111.018 177.363 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 77.8 mm-40 -65.1 -32.55 74.31 Favored 'General case' 0 N--CA 1.469 0.514 0 O-C-N 121.416 -0.802 . . . . 0.0 109.159 172.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 25.0 m-85 -77.71 10.78 2.47 Favored 'General case' 0 N--CA 1.431 -1.404 0 N-CA-C 114.148 1.166 . . . . 0.0 114.148 176.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.518 HG22 ' O ' ' A' ' 527' ' ' VAL . 22.1 m -75.26 6.79 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.657 0 C-N-CA 118.313 -1.355 . . . . 0.0 111.264 171.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 50.1 m-80 -93.59 -8.06 42.28 Favored 'General case' 0 C--N 1.307 -1.262 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.079 175.748 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 20.1 m -85.66 154.76 21.45 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 176.009 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 95.2 m-20 -71.71 -73.11 0.19 Allowed 'General case' 0 C--N 1.31 -1.137 0 N-CA-C 113.367 0.877 . . . . 0.0 113.367 178.535 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -81.22 -36.8 29.58 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 115.645 -0.707 . . . . 0.0 110.837 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . . . . . . . . . 43.9 tp -65.16 -34.6 78.77 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.649 -0.705 . . . . 0.0 110.865 -177.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . . . . . . . . . 38.2 ttp180 -57.89 -54.53 45.88 Favored 'General case' 0 C--O 1.254 1.315 0 CA-C-O 121.718 0.77 . . . . 0.0 109.344 176.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -53.42 -70.34 0.09 Allowed 'General case' 0 N--CA 1.425 -1.696 0 CA-C-N 113.369 -1.741 . . . . 0.0 110.669 -177.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.441 ' O ' HD13 ' A' ' 542' ' ' LEU 0.291 6.4 p -64.4 -52.69 56.91 Favored 'General case' 0 N--CA 1.425 -1.688 0 N-CA-C 116.536 2.05 . . . . 0.0 116.536 -173.18 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 51.8 tp -59.03 -44.43 91.74 Favored 'General case' 0 C--N 1.313 -0.994 0 N-CA-C 112.487 0.551 . . . . 0.0 112.487 -174.685 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 1.8 mp -75.04 -38.87 43.51 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.834 0 C-N-CA 119.551 -0.86 . . . . 0.0 109.43 -178.782 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 30.1 t -55.41 -45.6 76.71 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 115.952 -0.567 . . . . 0.0 110.484 175.717 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.499 ' O ' ' HB2' ' A' ' 545' ' ' TYR . 5.2 mp -64.95 -37.53 87.96 Favored 'General case' 0 C--O 1.21 -1.011 0 CA-C-N 115.656 -0.702 . . . . 0.0 111.063 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . 0.478 ' C ' ' H ' ' A' ' 545' ' ' TYR . 13.1 tp10 -64.99 -33.62 76.49 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 120.884 0.373 . . . . 0.0 110.886 179.399 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -76.43 40.9 0.23 Allowed 'General case' 0 N--CA 1.493 1.709 0 CA-C-O 123.048 1.404 . . . . 0.0 110.67 176.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . 0.499 ' HB2' ' O ' ' A' ' 542' ' ' LEU . 2.8 t80 -72.09 -172.69 0.92 Allowed 'General case' 0 C--N 1.283 -2.294 0 C-N-CA 128.658 2.783 . . . . 0.0 110.658 -176.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . 0.474 ' HB2' ' OD1' ' A' ' 548' ' ' ASN . 1.6 m-80 -85.98 172.08 10.94 Favored 'General case' 0 C--N 1.32 -0.68 0 N-CA-C 107.056 -1.461 . . . . 0.0 107.056 -179.601 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -80.02 14.19 1.94 Allowed 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.158 0.504 . . . . 0.0 111.689 179.962 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . 0.474 ' OD1' ' HB2' ' A' ' 546' ' ' ASN . 3.6 p-10 -75.94 -2.03 28.39 Favored 'General case' 0 C--N 1.307 -1.268 0 C-N-CA 123.901 0.88 . . . . 0.0 112.472 -176.625 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -69.75 33.34 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.749 0 N-CA-C 114.289 1.218 . . . . 0.0 114.289 -176.362 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.416 ' HB3' ' CD ' ' A' ' 551' ' ' PRO . 46.2 mt-10 -103.15 -176.99 0.48 Allowed Pre-proline 0 C--N 1.305 -1.336 0 N-CA-C 105.338 -2.097 . . . . 0.0 105.338 172.645 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . 0.416 ' CD ' ' HB3' ' A' ' 550' ' ' GLU . 33.7 Cg_exo -62.97 61.95 0.16 Allowed 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.433 2.089 . . . . 0.0 113.807 176.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 82.1 m-85 -135.22 37.73 2.97 Favored 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 105.839 -1.911 . . . . 0.0 105.839 174.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 39.7 mt-10 -67.9 67.12 0.1 Allowed 'General case' 0 C--N 1.308 -1.232 0 N-CA-C 115.172 1.545 . . . . 0.0 115.172 -171.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 12.3 m120 -71.3 -21.45 62.07 Favored 'General case' 0 CA--C 1.491 -1.31 0 C-N-CA 125.279 1.432 . . . . 0.0 108.573 172.452 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 7.3 mp0 -45.17 -45.31 11.46 Favored 'General case' 0 C--O 1.207 -1.174 0 C-N-CA 124.63 1.172 . . . . 0.0 109.222 171.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 53.9 mt -67.4 -44.21 87.13 Favored 'Isoleucine or valine' 0 C--O 1.201 -1.447 0 O-C-N 123.649 0.593 . . . . 0.0 109.483 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 67.3 m-20 -59.14 -47.34 85.64 Favored 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 120.97 0.415 . . . . 0.0 111.152 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -67.83 -42.47 81.41 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 123.073 0.549 . . . . 0.0 110.286 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . 0.579 ' O ' HG12 ' A' ' 563' ' ' ILE . 93.4 t80 -53.6 -51.57 62.6 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.809 1.244 . . . . 0.0 108.763 173.504 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . 0.484 HG13 HD13 ' A' ' 578' ' ' LEU . 9.6 t -55.07 -52.19 46.75 Favored 'Isoleucine or valine' 0 C--O 1.196 -1.751 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.483 175.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 3.0 t-20 -55.57 -38.01 68.78 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 123.34 0.656 . . . . 0.0 111.441 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 62.9 t -73.6 -32.93 37.47 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.908 0 N-CA-C 113.642 0.979 . . . . 0.0 113.642 177.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.579 HG12 ' O ' ' A' ' 559' ' ' TYR . 42.0 mm -90.59 -33.87 6.15 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.956 0 N-CA-C 107.12 -1.437 . . . . 0.0 107.12 -174.348 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 3.9 t-20 -86.61 14.64 6.6 Favored 'General case' 0 N--CA 1.437 -1.112 0 CA-C-N 113.783 -1.553 . . . . 0.0 108.14 176.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 7.4 tp10 -70.85 -19.76 62.61 Favored 'General case' 0 C--N 1.347 0.459 0 N-CA-C 105.494 -2.039 . . . . 0.0 105.494 169.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . 0.422 ' HE2' ' OE1' ' A' ' 469' ' ' GLN . 74.3 mmtt -77.12 -4.85 46.55 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 113.783 -1.553 . . . . 0.0 109.571 173.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -84.24 85.88 1.54 Allowed Glycine 0 CA--C 1.47 -2.74 0 CA-C-O 122.466 1.037 . . . . 0.0 113.091 -171.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 33.5 mt-30 -99.91 -62.98 1.17 Allowed 'General case' 0 C--N 1.266 -3.034 0 CA-C-N 113.115 -1.542 . . . . 0.0 107.442 173.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -131.77 171.38 13.58 Favored 'General case' 0 C--N 1.316 -0.875 0 CA-C-N 115.284 -0.871 . . . . 0.0 108.68 -179.798 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 97.6 m 70.55 -68.13 0.22 Allowed 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.507 0.928 . . . . 0.0 113.507 170.011 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 33.8 pt -70.94 -6.0 6.56 Favored 'Isoleucine or valine' 0 CA--C 1.484 -1.593 0 CA-C-O 121.512 0.672 . . . . 0.0 111.515 -177.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 14.9 mm-40 -69.58 -15.26 63.18 Favored 'General case' 0 N--CA 1.405 -2.72 0 CA-C-O 121.748 0.785 . . . . 0.0 110.69 175.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 22.9 t -69.22 -46.78 66.53 Favored 'General case' 0 N--CA 1.415 -2.223 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 169.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.557 ' O ' ' HG ' ' A' ' 578' ' ' LEU 0.276 3.7 pp -67.6 -22.36 65.37 Favored 'General case' 0 C--O 1.204 -1.332 0 C-N-CA 120.324 -0.55 . . . . 0.0 112.151 178.144 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 43.8 t-20 -55.91 -44.38 78.22 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 173.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 85.4 m-70 -59.14 -44.96 92.08 Favored 'General case' 0 CA--C 1.502 -0.898 0 CA-C-N 115.428 -0.806 . . . . 0.0 109.463 174.261 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 27.8 mmmt -62.62 -37.36 86.01 Favored 'General case' 0 C--O 1.205 -1.248 0 CA-C-N 114.728 -1.123 . . . . 0.0 112.015 -178.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.557 ' HG ' ' O ' ' A' ' 574' ' ' LEU . 91.0 mt -58.13 -39.64 79.24 Favored 'General case' 0 C--N 1.323 -0.582 0 C-N-CA 123.196 0.598 . . . . 0.0 110.753 176.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.56 ' HA ' ' HE ' ' A' ' 579' ' ' ARG . 4.8 mmp_? -60.26 -43.83 95.81 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-O 121.696 0.76 . . . . 0.0 110.792 175.468 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . 0.6 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 40.2 mt-10 -69.05 -34.08 74.62 Favored 'General case' 0 C--N 1.29 -1.993 0 CA-C-N 114.787 -1.097 . . . . 0.0 110.98 177.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -62.08 -49.31 76.44 Favored 'General case' 0 C--N 1.3 -1.545 0 C-N-CA 123.595 0.758 . . . . 0.0 111.932 176.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.668 ' O ' ' HB2' ' A' ' 586' ' ' ASP . 30.7 p -68.41 -27.72 66.45 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 122.135 0.174 . . . . 0.0 110.865 178.009 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.6 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 38.4 ttt180 -49.57 -7.47 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 C-N-CA 126.799 2.04 . . . . 0.0 114.051 -179.969 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 18.1 tt -81.81 31.65 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.593 2.602 0 CA-C-O 122.633 1.206 . . . . 0.0 109.476 175.611 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 129.32 56.43 0.1 Allowed Glycine 0 C--N 1.331 0.305 0 N-CA-C 110.477 -1.049 . . . . 0.0 110.477 178.386 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . 0.668 ' HB2' ' O ' ' A' ' 582' ' ' THR . 39.5 t0 -124.26 164.11 20.24 Favored 'General case' 0 C--N 1.318 -0.791 0 CA-C-O 121.353 0.597 . . . . 0.0 112.3 -171.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.431 ' HB ' ' HE3' ' A' ' 591' ' ' LYS . 2.2 t -67.43 22.98 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.578 2.051 0 C-N-CA 129.239 3.016 . . . . 0.0 109.018 171.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.606 ' H ' ' C ' ' A' ' 586' ' ' ASP . 32.9 tt0 -32.43 -40.28 0.05 OUTLIER 'General case' 0 C--O 1.198 -1.632 0 C-N-CA 130.639 3.576 . . . . 0.0 114.075 -168.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 11.2 mp -67.06 -49.37 65.32 Favored 'General case' 0 C--N 1.294 -1.823 0 C-N-CA 122.49 0.316 . . . . 0.0 111.05 -179.106 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -58.61 -45.1 89.87 Favored 'General case' 0 C--O 1.241 0.612 0 CA-C-O 122.278 1.037 . . . . 0.0 109.752 175.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.457 ' HD2' ' OD2' ' A' ' 586' ' ' ASP . 95.7 mttt -77.9 -25.8 48.68 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 114.669 -1.151 . . . . 0.0 112.581 -175.122 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 57.7 t80 -61.5 -43.52 98.72 Favored 'General case' 0 C--N 1.323 -0.565 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 173.702 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . 0.682 ' O ' HG12 ' A' ' 597' ' ' ILE . 79.2 t80 -60.22 -49.74 76.43 Favored 'General case' 0 C--O 1.203 -1.342 0 CA-C-N 115.212 -0.904 . . . . 0.0 109.266 176.386 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.407 ' O ' ' HB ' ' A' ' 597' ' ' ILE . 26.9 tp -54.31 -46.09 72.75 Favored 'General case' 0 N--CA 1.487 1.405 0 CA-C-O 121.909 0.861 . . . . 0.0 110.906 177.268 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -60.96 -50.66 72.49 Favored 'General case' 0 C--N 1.303 -1.421 0 CA-C-N 114.233 -1.349 . . . . 0.0 110.697 -177.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 20.4 pt20 -63.49 -32.58 74.08 Favored 'General case' 0 C--O 1.216 -0.693 0 C-N-CA 120.336 -0.546 . . . . 0.0 110.522 -179.323 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.682 HG12 ' O ' ' A' ' 593' ' ' TYR . 41.8 mm -55.89 -65.4 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.472 0.664 0 N-CA-C 109.367 -0.605 . . . . 0.0 109.367 175.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . 0.435 HG22 ' HE2' ' A' ' 602' ' ' LYS . 9.8 p -68.83 -36.73 75.59 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.606 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.566 -171.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . . . . . . . . . . . -65.51 -48.95 70.81 Favored 'General case' 0 N--CA 1.436 -1.159 0 CA-C-N 116.395 -0.366 . . . . 0.0 111.709 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 12.0 ptmm? -68.3 -19.78 64.71 Favored 'General case' 0 C--O 1.21 -1.019 0 C-N-CA 119.835 -0.746 . . . . 0.0 109.941 -179.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 3.3 t-20 -65.48 -43.68 89.46 Favored 'General case' 0 C--N 1.312 -1.041 0 CA-C-N 116.313 -0.403 . . . . 0.0 109.994 175.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.435 ' HE2' HG22 ' A' ' 598' ' ' VAL 0.281 46.5 mmtt -67.81 -56.18 10.17 Favored 'General case' 0 CA--C 1.486 -1.512 0 N-CA-C 106.002 -1.851 . . . . 0.0 106.002 177.166 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 11.1 tt0 -78.39 14.38 1.25 Allowed 'General case' 0 N--CA 1.401 -2.881 0 CA-C-N 110.937 -2.847 . . . . 0.0 112.857 -169.195 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 1.2 tpm_? -61.24 -48.97 79.03 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 109.279 -0.637 . . . . 0.0 109.279 171.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 15.0 tpt . . . . . 0 C--N 1.308 -1.213 0 N-CA-C 108.702 -0.851 . . . . 0.0 108.702 177.715 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 14.6 p90 . . . . . 0 N--CA 1.435 -1.202 0 CA-C-O 121.755 0.788 . . . . 0.0 111.843 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 6.6 p-10 -105.82 127.55 53.17 Favored 'General case' 0 C--N 1.284 -2.27 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 175.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -133.98 57.01 1.82 Allowed 'General case' 0 C--N 1.296 -1.733 0 N-CA-C 108.325 -0.991 . . . . 0.0 108.325 175.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 75.7 mt -63.73 144.68 56.84 Favored 'General case' 0 C--N 1.307 -1.252 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.077 -177.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 20.0 m -99.5 133.66 43.5 Favored 'General case' 0 C--N 1.294 -1.843 0 N-CA-C 107.59 -1.263 . . . . 0.0 107.59 177.255 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 36.5 ttm105 -60.01 -23.61 63.81 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 122.489 1.138 . . . . 0.0 109.255 179.487 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.583 ' O ' ' HG2' ' A' ' 473' ' ' GLU . 82.4 mt-30 -54.45 -38.14 66.01 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 126.4 1.88 . . . . 0.0 113.308 -177.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.498 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 1.8 tm-20 -68.45 -39.16 81.58 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 121.337 0.589 . . . . 0.0 109.629 -175.661 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -67.73 -33.5 74.99 Favored 'General case' 0 C--N 1.314 -0.973 0 CA-C-N 115.625 -0.716 . . . . 0.0 109.992 175.679 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -70.19 -39.98 74.91 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-N 116.048 -0.524 . . . . 0.0 110.703 178.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . 0.583 ' HG2' ' O ' ' A' ' 469' ' ' GLN . 6.6 mm-40 -60.88 -39.75 90.39 Favored 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 108.956 -0.757 . . . . 0.0 108.956 177.099 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.498 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 95.4 mtt180 -59.49 -47.2 86.43 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.898 176.566 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -65.36 -35.42 80.91 Favored 'General case' 0 N--CA 1.446 -0.66 0 CA-C-N 114.872 -1.058 . . . . 0.0 111.054 -178.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -58.63 -57.63 12.15 Favored 'General case' 0 C--N 1.318 -0.775 0 O-C-N 123.906 0.754 . . . . 0.0 109.42 179.165 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 27.3 mt -67.74 -31.61 71.65 Favored 'General case' 0 CA--C 1.54 0.59 0 CA-C-N 115.315 -0.857 . . . . 0.0 112.553 -175.926 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.422 ' HG3' ' HB3' ' A' ' 542' ' ' LEU 0.281 23.3 mmmt -102.54 -5.86 23.49 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 116.917 2.191 . . . . 0.0 116.917 -175.603 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 24.7 m170 -99.4 -22.32 15.59 Favored 'General case' 0 CA--C 1.488 -1.437 0 C-N-CA 119.21 -0.996 . . . . 0.0 110.848 173.204 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 48.6 tp -115.98 102.26 9.5 Favored 'General case' 0 N--CA 1.415 -2.176 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 178.139 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 24.0 mmt -67.49 -26.36 66.32 Favored 'General case' 0 N--CA 1.477 0.885 0 CA-C-O 122.394 1.093 . . . . 0.0 108.253 178.809 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . 0.634 ' HA ' ' NE2' ' A' ' 520' ' ' GLN . 3.4 mpt_? -69.14 -7.1 33.04 Favored 'General case' 0 N--CA 1.446 -0.669 0 CA-C-N 113.707 -1.588 . . . . 0.0 113.858 176.737 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . 0.472 ' CG ' ' HB ' ' A' ' 486' ' ' THR . 3.4 t70 -71.4 56.8 0.25 Allowed 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 122.517 1.151 . . . . 0.0 111.889 -176.751 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . 0.513 ' O ' ' HB3' ' A' ' 487' ' ' PHE . 82.3 tttt -93.77 -63.87 1.15 Allowed 'General case' 0 C--O 1.268 2.066 0 CA-C-O 123.066 1.412 . . . . 0.0 107.84 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 15.6 m-20 -60.92 -46.18 91.68 Favored 'General case' 0 CA--C 1.491 -1.307 0 CA-C-N 113.546 -1.661 . . . . 0.0 108.059 175.424 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.472 ' HB ' ' CG ' ' A' ' 483' ' ' ASP . 1.3 m -62.16 -35.7 79.6 Favored 'General case' 0 C--O 1.189 -2.127 0 CA-C-N 114.251 -1.34 . . . . 0.0 110.957 179.363 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . 0.513 ' HB3' ' O ' ' A' ' 484' ' ' LYS . 7.4 t80 -51.35 -56.37 13.47 Favored 'General case' 0 N--CA 1.473 0.691 0 CA-C-O 121.132 0.492 . . . . 0.0 110.708 174.436 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.58 -27.47 62.21 Favored 'General case' 0 C--N 1.31 -1.143 0 C-N-CA 118.541 -1.264 . . . . 0.0 110.667 179.717 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 8.9 t30 -75.18 -32.22 61.19 Favored 'General case' 0 C--O 1.211 -0.964 0 N-CA-C 112.073 0.398 . . . . 0.0 112.073 -179.284 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . 0.425 ' HD1' ' O ' ' A' ' 487' ' ' PHE . 0.0 OUTLIER -73.53 -37.68 65.53 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 106.046 -1.835 . . . . 0.0 106.046 -178.502 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . 0.507 ' HB2' ' O ' ' A' ' 487' ' ' PHE . 4.0 t80 -65.42 -42.26 92.69 Favored 'General case' 0 N--CA 1.411 -2.424 0 CA-C-N 112.467 -2.151 . . . . 0.0 109.706 -177.212 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -81.6 -32.21 32.16 Favored 'General case' 0 C--N 1.306 -1.313 0 CA-C-N 114.639 -1.164 . . . . 0.0 112.181 -176.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 35.1 m -83.45 -51.29 7.49 Favored 'General case' 0 N--CA 1.442 -0.833 0 N-CA-C 114.197 1.184 . . . . 0.0 114.197 -169.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 58.9 t -128.93 99.06 4.53 Favored 'Isoleucine or valine' 0 C--O 1.244 0.777 0 C-N-CA 118.067 -1.453 . . . . 0.0 113.363 -170.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 35.8 t70 34.26 87.04 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 127.701 2.4 . . . . 0.0 116.929 172.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 5.9 ptmt -90.14 -43.49 10.42 Favored 'General case' 0 C--N 1.306 -1.307 0 N-CA-C 113.583 0.957 . . . . 0.0 113.583 177.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 23.8 t70 -59.82 -61.53 2.55 Favored 'General case' 0 N--CA 1.484 1.264 0 N-CA-C 116.673 2.101 . . . . 0.0 116.673 -161.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 4.0 p30 -78.94 -10.99 59.98 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 118.769 -1.172 . . . . 0.0 110.723 -174.128 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -86.04 -17.02 36.33 Favored 'General case' 0 C--N 1.309 -1.158 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.778 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 30.3 m -63.02 113.73 3.27 Favored 'General case' 0 CA--C 1.54 0.582 0 N-CA-C 113.103 0.779 . . . . 0.0 113.103 -174.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -94.49 150.06 20.63 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 106.063 -1.828 . . . . 0.0 106.063 171.718 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 11.8 pt20 -57.88 -34.15 69.46 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 118.276 0.489 . . . . 0.0 111.025 -177.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . 0.413 ' O ' ' HB2' ' A' ' 506' ' ' TYR . 82.8 t60 -64.99 -50.37 66.6 Favored 'General case' 0 C--N 1.318 -0.768 0 C-N-CA 124.138 0.975 . . . . 0.0 109.726 -178.857 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 26.2 t80 -64.65 -31.09 72.16 Favored 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 116.06 -0.518 . . . . 0.0 110.747 175.502 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 60.1 tttp -65.38 -35.61 81.48 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.097 -0.705 . . . . 0.0 109.097 178.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.473 ' CG ' HD11 ' A' ' 535' ' ' LEU . 12.0 m-85 -59.21 -43.47 92.26 Favored 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 115.545 -0.752 . . . . 0.0 109.686 173.442 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . . . . . . . . . 9.7 t -61.73 -46.22 97.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 120.368 -0.533 . . . . 0.0 109.724 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 55.2 t80 -49.05 -44.44 41.72 Favored 'General case' 0 N--CA 1.481 1.094 0 O-C-N 123.406 0.441 . . . . 0.0 110.625 175.113 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -60.3 -48.28 82.43 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.38 -0.827 . . . . 0.0 111.035 -179.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.469 HG22 ' CE2' ' A' ' 529' ' ' TYR . 2.9 t -57.19 -43.49 81.82 Favored 'Isoleucine or valine' 0 C--O 1.194 -1.847 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 -179.044 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.739 ' HA ' ' HB3' ' A' ' 514' ' ' PHE . 94.7 mt -73.27 -34.27 65.71 Favored 'General case' 0 CA--C 1.565 1.544 0 N-CA-C 113.321 0.86 . . . . 0.0 113.321 -176.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 30.3 t60 -67.43 -42.92 82.39 Favored 'General case' 0 C--O 1.259 1.566 0 CA-C-O 122.257 1.027 . . . . 0.0 108.541 174.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -67.65 -25.42 65.71 Favored 'General case' 0 C--O 1.172 -3.019 0 CA-C-N 115.435 -0.802 . . . . 0.0 110.52 174.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . 0.882 ' O ' ' HA ' ' A' ' 518' ' ' ASN . 34.0 t80 -71.19 -16.39 62.52 Favored 'General case' 0 C--O 1.18 -2.58 0 C-N-CA 127.096 2.159 . . . . 0.0 111.459 174.97 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -79.85 -44.5 20.39 Favored 'General case' 0 C--N 1.28 -2.429 0 O-C-N 121.406 -0.809 . . . . 0.0 110.747 167.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.84 -53.48 32.09 Favored 'General case' 0 N--CA 1.485 1.294 0 CA-C-O 123.119 1.438 . . . . 0.0 108.692 175.299 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . 0.452 ' O ' ' HA ' ' A' ' 514' ' ' PHE . 45.2 mt-10 -95.33 63.64 2.58 Favored 'General case' 0 C--N 1.281 -2.404 0 C-N-CA 129.003 2.921 . . . . 0.0 104.842 173.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . 0.882 ' HA ' ' O ' ' A' ' 514' ' ' PHE . 12.0 t-20 -59.32 -148.18 0.0 OUTLIER 'General case' 0 C--O 1.203 -1.352 0 C-N-CA 129.886 3.275 . . . . 0.0 114.673 -164.346 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . 0.651 ' OD2' ' HG3' ' A' ' 520' ' ' GLN . 0.8 OUTLIER -34.07 -167.96 0.0 OUTLIER 'General case' 0 CA--C 1.592 2.579 0 N-CA-C 120.079 3.363 . . . . 0.0 120.079 -136.817 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . 0.651 ' HG3' ' OD2' ' A' ' 519' ' ' ASP 0.313 59.0 mt-30 -59.44 135.68 57.74 Favored 'General case' 0 N--CA 1.478 0.954 0 N-CA-C 120.941 3.682 . . . . 0.0 120.941 -146.456 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . 0.471 ' N ' ' HE1' ' A' ' 514' ' ' PHE . 5.2 t80 -41.61 133.37 2.67 Favored 'General case' 0 N--CA 1.416 -2.131 0 C-N-CA 131.09 3.756 . . . . 0.0 114.989 -177.181 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -119.25 163.91 16.42 Favored 'General case' 0 N--CA 1.428 -1.55 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.336 172.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 5.7 tt -54.17 -32.83 23.92 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.878 0 C-N-CA 124.225 1.01 . . . . 0.0 111.002 177.552 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.56 ' HA ' HG12 ' A' ' 527' ' ' VAL . 34.8 p -59.48 -32.79 70.57 Favored 'General case' 0 N--CA 1.425 -1.703 0 CA-C-N 115.529 -0.76 . . . . 0.0 112.212 179.55 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -69.89 -44.07 70.49 Favored 'General case' 0 C--O 1.254 1.314 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 177.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -61.03 -51.4 69.36 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.194 -0.912 . . . . 0.0 110.869 179.547 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.56 HG12 ' HA ' ' A' ' 524' ' ' SER . 9.9 p -69.21 -13.62 17.47 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.0 0 C-N-CA 123.14 0.576 . . . . 0.0 110.747 177.788 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -69.71 -33.85 73.09 Favored 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 174.088 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.469 ' CE2' HG22 ' A' ' 510' ' ' VAL 0.256 1.0 OUTLIER -80.63 15.85 1.57 Allowed 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 114.512 1.301 . . . . 0.0 114.512 172.392 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.459 HG23 ' HG3' ' A' ' 536' ' ' ARG . 3.7 p -73.36 5.17 0.73 Allowed 'Isoleucine or valine' 0 CA--C 1.578 2.042 0 CA-C-O 121.699 0.761 . . . . 0.0 109.83 177.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 58.8 t30 -95.55 -14.76 23.34 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 123.702 0.801 . . . . 0.0 110.745 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 8.7 t -106.36 124.49 49.67 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 175.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -58.4 -44.04 88.84 Favored 'General case' 0 C--N 1.32 -0.713 0 N-CA-C 113.803 1.038 . . . . 0.0 113.803 -170.266 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -78.25 -39.7 39.43 Favored 'General case' 0 C--N 1.305 -1.333 0 N-CA-C 113.118 0.785 . . . . 0.0 113.118 -178.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.473 HD11 ' CG ' ' A' ' 506' ' ' TYR . 96.7 mt -67.36 -36.4 81.31 Favored 'General case' 0 CA--C 1.496 -1.101 0 CA-C-O 119.429 -0.32 . . . . 0.0 111.649 177.447 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.459 ' HG3' HG23 ' A' ' 530' ' ' VAL . 67.5 ttt180 -49.26 -67.53 0.26 Allowed 'General case' 0 CA--C 1.504 -0.8 0 O-C-N 124.388 1.055 . . . . 0.0 110.522 179.219 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -62.13 -43.82 98.0 Favored 'General case' 0 N--CA 1.425 -1.71 0 CA-C-N 115.545 -0.752 . . . . 0.0 112.439 -176.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.46 ' O ' HD13 ' A' ' 542' ' ' LEU . 12.0 m -63.08 -54.62 35.16 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 120.217 -0.593 . . . . 0.0 112.542 -178.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -63.23 -37.01 85.55 Favored 'General case' 0 CA--C 1.498 -1.035 0 N-CA-C 113.083 0.772 . . . . 0.0 113.083 -178.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 38.5 mm -68.14 -38.87 80.38 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.116 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 176.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 70.1 m -57.03 -41.05 77.89 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-O 121.192 0.52 . . . . 0.0 110.741 171.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.484 HD21 ' HB3' ' A' ' 474' ' ' ARG . 7.8 mp -70.65 -24.77 62.77 Favored 'General case' 0 C--N 1.312 -1.04 0 C-N-CA 123.198 0.599 . . . . 0.0 112.129 176.343 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 14.2 tp10 -84.86 -35.87 21.93 Favored 'General case' 0 C--N 1.317 -0.83 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.658 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 5.3 pp0? -71.33 29.51 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -176.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -61.93 148.67 42.9 Favored 'General case' 0 C--O 1.257 1.481 0 CA-C-O 121.707 0.765 . . . . 0.0 111.894 -175.187 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 63.8 t30 -84.04 -176.37 6.24 Favored 'General case' 0 C--N 1.304 -1.379 0 CA-C-N 115.215 -0.902 . . . . 0.0 110.351 -171.143 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.428 ' C ' ' H ' ' A' ' 549' ' ' ASP . 7.4 mp -72.27 17.97 0.1 Allowed 'General case' 0 C--O 1.205 -1.253 0 C-N-CA 124.461 1.105 . . . . 0.0 112.458 -179.132 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . 0.406 ' C ' ' H ' ' A' ' 550' ' ' GLU . 17.0 m120 -75.04 20.83 0.13 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.149 0.98 . . . . 0.0 111.774 178.778 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . 0.428 ' H ' ' C ' ' A' ' 547' ' ' LEU . 25.1 t70 -72.69 33.06 0.07 Allowed 'General case' 0 CA--C 1.569 1.689 0 C-N-CA 125.972 1.709 . . . . 0.0 111.911 -176.51 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.406 ' H ' ' C ' ' A' ' 548' ' ' ASN . 17.0 mm-40 -73.94 170.54 14.09 Favored Pre-proline 0 C--N 1.304 -1.387 0 C-N-CA 124.852 1.261 . . . . 0.0 108.649 177.695 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 21.4 Cg_exo -69.27 73.97 1.1 Allowed 'Trans proline' 0 CA--C 1.544 1.023 0 C-N-CA 121.862 1.708 . . . . 0.0 110.21 171.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 26.6 t80 -96.24 42.33 1.09 Allowed 'General case' 0 C--N 1.309 -1.174 0 C-N-CA 126.495 1.918 . . . . 0.0 108.356 -178.212 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . 0.585 ' O ' HG12 ' A' ' 556' ' ' ILE . 50.3 mt-10 -71.44 1.02 6.97 Favored 'General case' 0 C--N 1.281 -2.41 0 CA-C-N 114.633 -1.167 . . . . 0.0 112.464 -178.35 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 15.6 m120 -68.36 -21.47 64.72 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.956 1.702 . . . . 0.0 108.909 171.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 5.1 tp10 -46.01 -49.18 16.39 Favored 'General case' 0 C--N 1.347 0.498 0 C-N-CA 124.065 0.946 . . . . 0.0 110.476 179.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . 0.585 HG12 ' O ' ' A' ' 553' ' ' GLU . 45.4 pt -64.67 -36.46 77.55 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.127 0 C-N-CA 123.342 0.657 . . . . 0.0 110.852 -178.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . 0.44 ' OD1' HD13 ' A' ' 594' ' ' LEU . 14.3 m-20 -61.31 -50.9 71.09 Favored 'General case' 0 C--O 1.251 1.167 0 C-N-CA 123.533 0.733 . . . . 0.0 110.693 178.146 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . 0.441 ' O ' HG23 ' A' ' 562' ' ' VAL . 13.1 t70 -66.99 -42.89 84.3 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-N 115.174 -0.921 . . . . 0.0 108.733 179.672 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . 0.633 ' CZ ' HG13 ' A' ' 563' ' ' ILE . 52.9 t80 -54.19 -53.85 47.88 Favored 'General case' 0 C--O 1.213 -0.822 0 CA-C-N 114.83 -1.077 . . . . 0.0 110.936 178.009 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 32.0 t -55.12 -47.46 77.22 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.383 0 C-N-CA 122.796 0.438 . . . . 0.0 111.537 -177.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.555 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 47.9 t30 -59.02 -47.24 85.94 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 122.342 0.257 . . . . 0.0 110.523 176.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . 0.441 HG23 ' O ' ' A' ' 558' ' ' ASP . 83.1 t -63.8 -41.76 93.64 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.822 0 CA-C-O 121.436 0.636 . . . . 0.0 111.877 -178.543 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.633 HG13 ' CZ ' ' A' ' 559' ' ' TYR . 50.4 mm -83.25 -33.9 10.55 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.016 0 CA-C-O 121.489 0.662 . . . . 0.0 109.866 -172.694 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 9.1 t30 -73.95 -12.15 60.56 Favored 'General case' 0 N--CA 1.424 -1.763 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 177.277 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.555 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 34.3 mt-10 -63.43 -15.75 58.57 Favored 'General case' 0 C--N 1.362 1.151 0 C-N-CA 119.909 -0.716 . . . . 0.0 109.737 174.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 95.9 mttt -57.42 -25.96 60.4 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 116.235 -0.439 . . . . 0.0 110.339 175.161 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -129.96 -39.89 0.27 Allowed Glycine 0 N--CA 1.442 -0.919 0 C-N-CA 121.153 -0.546 . . . . 0.0 112.899 -179.464 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 70.65 -71.95 0.12 Allowed 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 125.756 1.623 . . . . 0.0 110.233 -177.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 16.6 tp10 73.39 -77.18 0.06 Allowed 'General case' 0 C--N 1.326 -0.453 0 C-N-CA 125.721 1.609 . . . . 0.0 114.009 174.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . 0.482 ' O ' ' HG ' ' A' ' 574' ' ' LEU . 1.1 m -152.21 160.26 43.41 Favored 'General case' 0 C--N 1.309 -1.183 0 N-CA-C 108.358 -0.979 . . . . 0.0 108.358 -177.048 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 48.6 mm -56.82 -45.7 83.23 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.86 0 CA-C-O 121.961 0.886 . . . . 0.0 109.211 173.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 7.7 tp10 -68.03 -34.55 76.69 Favored 'General case' 0 N--CA 1.422 -1.826 0 CA-C-N 114.437 -1.256 . . . . 0.0 110.649 -173.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 22.8 t -62.95 -38.25 90.3 Favored 'General case' 0 C--O 1.259 1.554 0 CA-C-N 115.497 -0.774 . . . . 0.0 109.341 178.748 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 570' ' ' THR . 43.8 mt -60.7 -53.01 62.59 Favored 'General case' 0 CA--C 1.503 -0.836 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 175.504 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -52.62 -50.38 63.21 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 114.126 -1.397 . . . . 0.0 112.759 -174.944 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 47.6 t60 -59.8 -50.95 71.81 Favored 'General case' 0 C--N 1.326 -0.423 0 C-N-CA 120.078 -0.649 . . . . 0.0 110.462 178.28 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 36.2 mtmm -67.55 -32.37 73.09 Favored 'General case' 0 C--N 1.32 -0.702 0 N-CA-C 114.087 1.143 . . . . 0.0 114.087 -176.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 7.8 mp -60.89 -52.56 64.51 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 121.214 0.53 . . . . 0.0 110.462 174.062 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.468 ' HB3' ' HE3' ' A' ' 591' ' ' LYS . 56.6 mtm180 -63.95 -35.06 79.43 Favored 'General case' 0 C--O 1.245 0.848 0 CA-C-O 122.221 1.01 . . . . 0.0 111.151 -179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . 0.492 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 6.0 tp10 -64.87 -33.28 75.63 Favored 'General case' 0 C--N 1.311 -1.089 0 CA-C-N 114.72 -1.127 . . . . 0.0 110.108 178.454 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -63.38 -50.49 69.7 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-N 116.165 -0.47 . . . . 0.0 110.783 174.237 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.452 ' HB ' ' HB2' ' A' ' 591' ' ' LYS 0.254 0.7 OUTLIER -59.82 -24.27 64.02 Favored 'General case' 0 N--CA 1.468 0.428 0 N-CA-C 114.442 1.275 . . . . 0.0 114.442 -178.555 . . . . . . . . 4 4 . 1 . 015 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.492 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 10.9 ttp85 -43.34 -9.02 0.01 OUTLIER 'General case' 0 CA--C 1.605 3.062 0 C-N-CA 124.846 1.259 . . . . 0.0 114.227 169.658 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 2.5 pp -68.7 10.25 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.54 0 N-CA-C 115.186 1.55 . . . . 0.0 115.186 -176.248 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 130.01 -54.71 0.78 Allowed Glycine 0 C--N 1.289 -2.03 0 C-N-CA 120.237 -0.982 . . . . 0.0 114.234 174.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . 0.475 ' OD2' ' HB3' ' A' ' 589' ' ' LEU . 20.7 t70 -86.33 81.15 8.47 Favored 'General case' 0 CA--C 1.5 -0.95 0 C-N-CA 118.092 -1.443 . . . . 0.0 109.111 176.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.629 ' O ' ' HB3' ' A' ' 591' ' ' LYS . 96.5 t -73.18 -51.54 25.68 Favored 'Isoleucine or valine' 0 C--N 1.282 -2.331 0 CA-C-N 113.635 -1.62 . . . . 0.0 111.207 -179.86 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -62.01 -57.16 12.72 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 114.316 1.228 . . . . 0.0 114.316 -169.584 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . 0.475 ' HB3' ' OD2' ' A' ' 586' ' ' ASP . 50.6 tp -73.21 -64.07 1.05 Allowed 'General case' 0 C--N 1.296 -1.737 0 N-CA-C 111.85 0.315 . . . . 0.0 111.85 -175.75 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 -51.86 -58.68 5.76 Favored 'General case' 0 CA--C 1.495 -1.158 0 CA-C-N 115.778 -0.646 . . . . 0.0 112.41 -178.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.629 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 83.8 tttt -63.71 -40.08 95.87 Favored 'General case' 0 N--CA 1.428 -1.545 0 CA-C-O 118.072 -0.966 . . . . 0.0 111.007 -173.508 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 86.0 t80 -53.01 -55.35 24.26 Favored 'General case' 0 C--N 1.362 1.139 0 CA-C-N 118.797 0.726 . . . . 0.0 111.469 179.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . 0.438 ' O ' HG13 ' A' ' 597' ' ' ILE . 63.6 m-85 -61.61 -52.08 65.85 Favored 'General case' 0 CA--C 1.506 -0.72 0 CA-C-O 120.804 0.335 . . . . 0.0 111.831 -179.575 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.44 HD13 ' OD1' ' A' ' 557' ' ' ASP . 56.9 mt -62.91 -41.83 99.58 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -175.193 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.594 ' HG2' ' O ' ' A' ' 591' ' ' LYS . 13.2 pt20 -71.44 -35.27 70.87 Favored 'General case' 0 C--O 1.217 -0.651 0 C-N-CA 120.869 -0.332 . . . . 0.0 111.35 177.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -67.05 -39.12 86.86 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 111.503 0.186 . . . . 0.0 111.503 177.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.438 HG13 ' O ' ' A' ' 593' ' ' TYR . 70.9 mt -55.51 -55.83 15.11 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 CA-C-N 116.085 -0.507 . . . . 0.0 110.272 175.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 9.5 p -67.91 -32.14 55.07 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.062 0 CA-C-N 116.408 -0.36 . . . . 0.0 111.759 179.093 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.495 ' O ' ' HG3' ' A' ' 602' ' ' LYS . . . -62.87 -44.53 95.87 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.148 0.499 . . . . 0.0 110.699 177.425 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 15.9 tppt? -70.45 -34.52 72.54 Favored 'General case' 0 N--CA 1.435 -1.219 0 CA-C-N 116.293 -0.412 . . . . 0.0 109.956 178.012 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 63.0 t30 -66.69 -42.3 86.71 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.77 0.319 . . . . 0.0 111.231 178.484 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.495 ' HG3' ' O ' ' A' ' 599' ' ' ALA . 0.0 OUTLIER -69.57 -30.35 68.11 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.973 0.416 . . . . 0.0 110.198 179.993 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 23.6 tt0 -72.52 -32.59 66.25 Favored 'General case' 0 C--N 1.325 -0.487 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.907 177.26 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -74.38 -4.9 39.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 114.772 -1.104 . . . . 0.0 111.069 -176.793 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 95.7 mmm . . . . . 0 C--O 1.255 1.349 0 CA-C-O 118.446 -0.788 . . . . 0.0 109.385 -177.883 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 . . . . . 0 N--CA 1.439 -1.022 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 60.3 m-20 -110.19 92.31 4.0 Favored 'General case' 0 C--N 1.298 -1.653 0 N-CA-C 108.456 -0.942 . . . . 0.0 108.456 175.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 28.3 t-20 -135.09 80.39 1.84 Allowed 'General case' 0 C--N 1.288 -2.106 0 N-CA-C 108.673 -0.862 . . . . 0.0 108.673 -179.228 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 6.7 mp -69.45 99.44 1.24 Allowed 'General case' 0 C--N 1.29 -2.007 0 N-CA-C 108.23 -1.026 . . . . 0.0 108.23 178.072 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 48.4 m -75.32 106.0 6.63 Favored 'General case' 0 N--CA 1.42 -1.938 0 CA-C-O 121.554 0.692 . . . . 0.0 111.087 -175.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.8 mtt180 -69.82 -16.16 63.23 Favored 'General case' 0 N--CA 1.433 -1.29 0 CA-C-N 115.074 -0.966 . . . . 0.0 111.404 175.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.454 HE21 HG23 ' A' ' 563' ' ' ILE . 52.6 mt-30 -59.66 -48.31 82.19 Favored 'General case' 0 C--O 1.189 -2.087 0 O-C-N 123.415 0.447 . . . . 0.0 110.075 173.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 6.4 tm-20 -60.0 -30.66 69.29 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-O 122.181 0.991 . . . . 0.0 109.887 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 28.3 mmtm -72.85 -32.13 65.24 Favored 'General case' 0 N--CA 1.444 -0.757 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.374 174.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.49 -44.51 64.57 Favored 'General case' 0 N--CA 1.426 -1.673 0 CA-C-N 115.924 -0.58 . . . . 0.0 109.963 -178.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . 0.448 ' O ' ' HB2' ' A' ' 477' ' ' LEU . 3.0 mp0 -55.6 -44.97 77.5 Favored 'General case' 0 C--N 1.349 0.581 0 O-C-N 123.349 0.406 . . . . 0.0 110.026 173.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.43 -44.83 95.48 Favored 'General case' 0 CA--C 1.536 0.438 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 -179.606 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -64.01 -51.19 65.38 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 120.752 0.31 . . . . 0.0 111.053 -179.21 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -63.75 -18.97 64.58 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-O 121.337 0.589 . . . . 0.0 111.758 -179.571 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.481 ' O ' HD13 ' A' ' 477' ' ' LEU . 3.0 tm? -77.25 -26.91 53.02 Favored 'General case' 0 C--N 1.31 -1.137 0 C-N-CA 123.868 0.867 . . . . 0.0 110.423 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 33.8 tttm -53.65 -70.67 0.09 Allowed 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.234 0.614 . . . . 0.0 111.012 -172.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.552 ' HB3' ' HB2' ' A' ' 483' ' ' ASP . 32.5 m80 61.54 -170.53 0.16 Allowed 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 123.962 0.905 . . . . 0.0 112.347 176.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 91.5 mt -115.11 175.54 5.46 Favored 'General case' 0 N--CA 1.437 -1.122 0 N-CA-C 105.959 -1.867 . . . . 0.0 105.959 167.332 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . 0.42 ' HG3' ' O ' ' A' ' 521' ' ' TYR . 1.6 mpt? -73.6 -17.81 61.13 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-O 121.472 0.653 . . . . 0.0 110.282 -178.921 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 98.3 mtt180 -65.12 -35.03 79.84 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-N 115.018 -0.992 . . . . 0.0 110.802 175.631 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . 0.552 ' HB2' ' HB3' ' A' ' 479' ' ' HIS . 26.9 m-20 -70.85 52.79 0.15 Allowed 'General case' 0 C--N 1.306 -1.288 0 N-CA-C 116.371 1.989 . . . . 0.0 116.371 -169.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -70.7 -42.45 70.63 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.582 -0.895 . . . . 0.0 108.582 175.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.83 -51.78 66.84 Favored 'General case' 0 CA--C 1.501 -0.938 0 CA-C-N 114.586 -1.188 . . . . 0.0 109.797 177.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.514 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 6.0 m -59.73 -32.93 71.01 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-N 115.247 -0.888 . . . . 0.0 112.245 -177.768 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 3.2 t80 -59.94 -54.82 41.61 Favored 'General case' 0 C--N 1.347 0.464 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 173.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 89.0 mt -69.98 -29.85 67.05 Favored 'General case' 0 C--N 1.316 -0.891 0 C-N-CA 120.45 -0.5 . . . . 0.0 111.872 -178.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 64.7 t30 -65.02 -41.72 95.03 Favored 'General case' 0 CA--C 1.505 -0.77 0 CA-C-O 121.259 0.552 . . . . 0.0 109.794 -178.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -83.97 -37.91 21.66 Favored 'General case' 0 N--CA 1.411 -2.421 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.123 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 28.8 t80 -63.36 -40.08 96.29 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 179.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -73.63 -20.3 60.62 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-O 121.516 0.674 . . . . 0.0 110.305 -178.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 39.4 m -79.02 -11.65 60.01 Favored 'General case' 0 C--N 1.315 -0.933 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.109 177.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . 0.503 HG13 ' HB2' ' A' ' 497' ' ' ASP . 55.1 t -94.97 129.85 44.55 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.234 0 CA-C-N 115.309 -0.859 . . . . 0.0 108.842 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 28.5 t70 -156.09 -60.37 0.1 Allowed 'General case' 0 C--N 1.304 -1.375 0 CA-C-N 115.85 -0.614 . . . . 0.0 109.703 175.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 12.9 mptt -82.06 -19.68 39.79 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-O 122.103 0.954 . . . . 0.0 109.561 178.358 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . 0.503 ' HB2' HG13 ' A' ' 494' ' ' VAL . 0.6 OUTLIER -69.31 -0.9 6.89 Favored 'General case' 0 C--N 1.31 -1.126 0 C-N-CA 126.203 1.801 . . . . 0.0 111.172 -177.523 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 40.0 m-80 -75.59 19.6 0.19 Allowed 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 123.295 0.638 . . . . 0.0 111.822 -179.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 41.1 p90 -79.02 -16.99 56.11 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 107.634 -1.247 . . . . 0.0 107.634 173.737 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 13.6 t -58.96 168.41 1.3 Allowed 'General case' 0 CA--C 1.559 1.29 0 C-N-CA 124.843 1.257 . . . . 0.0 111.997 -177.846 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -66.24 167.31 10.47 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 113.318 0.859 . . . . 0.0 113.318 -175.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 46.4 tp60 -63.59 -12.84 36.31 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 125.572 1.549 . . . . 0.0 109.55 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . . . . . . . . . 46.0 m170 -56.23 -44.34 79.51 Favored 'General case' 0 C--N 1.317 -0.82 0 C-N-CA 124.721 1.208 . . . . 0.0 109.243 177.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -60.49 -34.87 74.69 Favored 'General case' 0 C--O 1.224 -0.288 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.954 177.799 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -70.12 -43.88 70.06 Favored 'General case' 0 N--CA 1.433 -1.278 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -176.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.5 ' O ' HG23 ' A' ' 510' ' ' VAL . 73.9 m-85 -59.89 -46.16 90.21 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 115.998 -0.546 . . . . 0.0 111.448 178.679 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . 0.462 HG21 ' HG ' ' A' ' 477' ' ' LEU . 27.1 m -71.07 -47.17 63.07 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.324 0 CA-C-O 118.916 -0.564 . . . . 0.0 112.282 -178.17 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 31.7 t80 -51.53 -48.87 62.86 Favored 'General case' 0 N--CA 1.473 0.677 0 O-C-N 123.585 0.553 . . . . 0.0 111.835 176.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -55.91 -52.07 65.41 Favored 'General case' 0 C--O 1.242 0.694 0 O-C-N 124.029 0.83 . . . . 0.0 110.346 -178.433 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.5 HG23 ' O ' ' A' ' 506' ' ' TYR . 79.0 t -60.18 -50.85 78.6 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.655 0 CA-C-N 115.562 -0.745 . . . . 0.0 111.311 178.067 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 92.5 mt -58.53 -55.77 30.78 Favored 'General case' 0 C--O 1.198 -1.625 0 O-C-N 124.078 0.861 . . . . 0.0 111.741 -176.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 69.3 t60 -59.95 -39.06 84.28 Favored 'General case' 0 C--N 1.32 -0.706 0 O-C-N 123.57 0.544 . . . . 0.0 111.694 -176.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 30.3 t70 -66.04 -51.43 58.29 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 116.524 -0.307 . . . . 0.0 111.645 -178.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -71.3 -39.29 71.55 Favored 'General case' 0 C--O 1.176 -2.804 0 C-N-CA 120.007 -0.677 . . . . 0.0 110.871 179.786 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -53.19 -39.39 63.61 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 122.773 0.429 . . . . 0.0 110.419 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -69.15 -37.54 78.31 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 -178.276 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 70.3 mm-40 -123.01 -2.31 8.7 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 114.309 1.226 . . . . 0.0 114.309 -171.11 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -150.2 -151.36 0.39 Allowed 'General case' 0 C--N 1.274 -2.698 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 -172.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -93.43 -163.71 1.08 Allowed 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 124.708 1.203 . . . . 0.0 111.868 -173.102 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.64 160.52 14.22 Favored 'General case' 0 C--N 1.314 -0.972 0 N-CA-C 106.986 -1.487 . . . . 0.0 106.986 -179.687 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . 0.42 ' O ' ' HG3' ' A' ' 481' ' ' MET . 4.0 t80 -41.74 132.2 3.01 Favored 'General case' 0 N--CA 1.415 -2.193 0 C-N-CA 126.816 2.046 . . . . 0.0 115.453 -179.195 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 19.6 m120 -116.83 159.15 22.79 Favored 'General case' 0 N--CA 1.42 -1.936 0 N-CA-C 105.892 -1.892 . . . . 0.0 105.892 171.015 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 2.4 pp -77.17 -18.91 14.37 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.399 0 CA-C-O 121.805 0.812 . . . . 0.0 108.819 -179.582 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.504 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 8.0 m -57.14 -36.63 70.94 Favored 'General case' 0 N--CA 1.433 -1.293 0 CA-C-N 114.284 -1.325 . . . . 0.0 110.095 172.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -64.21 -38.34 90.69 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.343 0.592 . . . . 0.0 109.7 -179.179 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.49 ' O ' HG13 ' A' ' 530' ' ' VAL . . . -60.95 -46.9 88.86 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 115.423 -0.808 . . . . 0.0 109.814 177.422 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.558 ' O ' HG22 ' A' ' 530' ' ' VAL . 82.7 t -61.95 -36.55 74.63 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 C-N-CA 124.715 1.206 . . . . 0.0 111.444 178.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . 0.504 ' HG3' ' O ' ' A' ' 524' ' ' SER . 77.9 mt-30 -62.86 -36.08 82.08 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-O 121.651 0.739 . . . . 0.0 110.067 178.03 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.541 ' CG ' ' HD3' ' A' ' 536' ' ' ARG . 0.3 OUTLIER -76.15 -15.01 60.15 Favored 'General case' 0 C--N 1.308 -1.197 0 CA-C-N 115.272 -0.876 . . . . 0.0 112.68 -176.755 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.558 HG22 ' O ' ' A' ' 527' ' ' VAL . 17.3 m -86.19 18.29 0.48 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.715 0 N-CA-C 116.037 1.865 . . . . 0.0 116.037 -170.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 42.3 m-80 -96.99 -27.23 14.71 Favored 'General case' 0 C--N 1.297 -1.687 0 N-CA-C 105.588 -2.005 . . . . 0.0 105.588 171.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . 0.401 ' C ' ' H ' ' A' ' 534' ' ' GLU . 14.9 m -92.8 -142.33 0.21 Allowed 'General case' 0 C--N 1.292 -1.923 0 C-N-CA 128.871 2.868 . . . . 0.0 107.007 174.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . 0.429 ' O ' ' N ' ' A' ' 535' ' ' LEU . 13.4 m120 -29.08 28.08 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.851 1 C-N-CA 136.365 5.866 . . . . 0.0 117.559 173.161 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . 0.712 ' O ' ' HG3' ' A' ' 537' ' ' GLU . 10.4 pt-20 -33.28 2.27 0.0 OUTLIER 'General case' 0 N--CA 1.512 2.633 0 C-N-CA 131.32 3.848 . . . . 0.0 116.348 178.731 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.455 ' O ' ' HB ' ' A' ' 538' ' ' THR . 3.1 pp -64.93 -17.19 64.14 Favored 'General case' 0 C--N 1.289 -2.055 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 162.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.541 ' HD3' ' CG ' ' A' ' 529' ' ' TYR . 21.0 ttt180 -80.52 -11.99 59.59 Favored 'General case' 0 N--CA 1.402 -2.855 0 CA-C-N 113.149 -1.841 . . . . 0.0 111.288 174.274 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . 0.712 ' HG3' ' O ' ' A' ' 534' ' ' GLU . 0.1 OUTLIER -79.15 -32.35 44.3 Favored 'General case' 0 CA--C 1.475 -1.909 0 N-CA-C 106.74 -1.578 . . . . 0.0 106.74 171.921 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.455 ' HB ' ' O ' ' A' ' 535' ' ' LEU . 62.4 m -59.54 -43.22 93.54 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 114.663 -1.153 . . . . 0.0 109.189 170.328 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 11.2 tp -56.75 -40.51 75.92 Favored 'General case' 0 C--O 1.199 -1.562 0 CA-C-N 114.851 -1.068 . . . . 0.0 109.136 175.224 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . 0.479 HD11 ' HA ' ' A' ' 527' ' ' VAL . 80.6 mt -61.17 -49.24 85.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 C-N-CA 122.81 0.444 . . . . 0.0 110.391 176.071 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 40.4 m -54.26 -43.23 70.8 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.854 0.835 . . . . 0.0 110.668 177.408 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 34.5 tp -72.75 -25.4 61.18 Favored 'General case' 0 CA--C 1.565 1.556 0 CA-C-N 114.984 -1.007 . . . . 0.0 111.208 177.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 18.8 tp10 -79.73 -28.09 40.54 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 124.717 1.207 . . . . 0.0 109.656 -178.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 58.4 tp60 -68.45 -27.49 66.21 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 114.995 -1.002 . . . . 0.0 109.739 -179.023 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 1.5 m-85 -65.76 115.01 5.45 Favored 'General case' 0 N--CA 1.433 -1.277 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.177 178.158 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . 0.438 ' ND2' ' HB2' ' A' ' 549' ' ' ASP . 58.1 t30 -109.06 82.56 1.61 Allowed 'General case' 0 C--N 1.302 -1.494 0 C-N-CA 119.227 -0.989 . . . . 0.0 111.317 -174.757 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -84.48 -15.4 46.14 Favored 'General case' 0 C--N 1.303 -1.441 0 CA-C-N 115.274 -0.875 . . . . 0.0 109.735 176.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 21.2 t-20 -78.71 -3.1 42.53 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.599 -0.728 . . . . 0.0 111.443 -178.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . 0.438 ' HB2' ' ND2' ' A' ' 546' ' ' ASN . 19.0 t70 -62.57 -44.06 97.27 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-O 121.903 0.859 . . . . 0.0 109.187 176.162 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 28.7 mt-10 -85.34 156.87 59.51 Favored Pre-proline 0 C--N 1.291 -1.956 0 N-CA-C 106.975 -1.491 . . . . 0.0 106.975 178.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_exo -50.89 112.03 0.68 Allowed 'Trans proline' 0 C--N 1.358 1.032 0 C-N-CA 122.277 1.984 . . . . 0.0 108.816 173.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 40.1 t80 -118.46 31.81 6.47 Favored 'General case' 0 C--N 1.307 -1.241 0 CA-C-O 121.636 0.731 . . . . 0.0 110.109 -169.571 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -70.91 -6.09 35.75 Favored 'General case' 0 C--N 1.305 -1.331 0 CA-C-N 115.378 -0.828 . . . . 0.0 111.677 -179.322 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -66.34 -20.73 66.16 Favored 'General case' 0 C--O 1.214 -0.79 0 C-N-CA 124.984 1.314 . . . . 0.0 109.617 171.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . 0.415 ' HG3' HG13 ' A' ' 556' ' ' ILE . 8.8 pt-20 -37.78 -54.29 1.24 Allowed 'General case' 0 C--O 1.204 -1.306 0 C-N-CA 123.798 0.839 . . . . 0.0 113.026 179.733 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . 0.415 HG13 ' HG3' ' A' ' 555' ' ' GLU . 20.5 mt -67.61 -42.64 86.88 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.598 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 -176.592 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -56.06 -52.46 64.17 Favored 'General case' 0 N--CA 1.473 0.697 0 O-C-N 123.898 0.748 . . . . 0.0 110.121 178.646 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -65.03 -57.88 7.52 Favored 'General case' 0 N--CA 1.469 0.514 0 CA-C-N 115.711 -0.677 . . . . 0.0 110.745 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . . . . . . . . . 74.9 t80 -50.99 -54.14 27.08 Favored 'General case' 0 C--N 1.318 -0.762 0 C-N-CA 124.932 1.293 . . . . 0.0 112.615 -176.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . 0.664 ' HB ' HD21 ' A' ' 578' ' ' LEU . 53.1 t -71.52 -40.65 72.0 Favored 'Isoleucine or valine' 0 C--O 1.203 -1.386 0 C-N-CA 119.354 -0.938 . . . . 0.0 110.594 -176.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 5.9 t-20 -60.29 -34.82 74.3 Favored 'General case' 0 N--CA 1.486 1.332 0 CA-C-N 117.959 0.345 . . . . 0.0 110.686 178.7 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . . . . . . . . . 61.2 t -69.26 -36.5 72.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 CA-C-O 121.383 0.611 . . . . 0.0 111.907 177.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.454 HG23 HE21 ' A' ' 469' ' ' GLN . 60.2 mt -84.63 -36.5 11.62 Favored 'Isoleucine or valine' 0 C--N 1.29 -2.01 0 CA-C-O 122.204 1.002 . . . . 0.0 108.328 -176.09 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . 0.428 HD21 ' HB2' ' A' ' 575' ' ' ASN . 10.0 t30 -81.56 7.21 12.68 Favored 'General case' 0 C--N 1.308 -1.202 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.348 176.34 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -71.66 -20.3 61.97 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 105.806 -1.924 . . . . 0.0 105.806 172.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 34.4 mmtp -95.24 33.6 1.53 Allowed 'General case' 0 CA--C 1.55 0.98 0 CA-C-N 113.925 -1.489 . . . . 0.0 107.383 172.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -75.86 64.58 2.65 Favored Glycine 0 CA--C 1.501 -0.824 0 C-N-CA 124.957 1.265 . . . . 0.0 116.089 -170.653 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -87.88 -178.17 5.96 Favored 'General case' 0 C--N 1.281 -2.404 0 N-CA-C 107.345 -1.354 . . . . 0.0 107.345 168.673 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 14.2 pt-20 -56.36 149.81 15.97 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 118.405 0.548 . . . . 0.0 109.737 178.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 44.3 m 84.68 -40.87 0.06 Allowed 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.804 1.242 . . . . 0.0 109.612 -174.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 12.5 mm -88.71 -31.3 5.5 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.053 0 N-CA-C 106.315 -1.735 . . . . 0.0 106.315 -177.187 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -60.24 -15.71 27.17 Favored 'General case' 0 C--N 1.315 -0.912 0 C-N-CA 125.17 1.388 . . . . 0.0 110.801 179.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 9.4 m -63.57 -32.0 73.34 Favored 'General case' 0 N--CA 1.43 -1.443 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 174.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 79.4 mt -66.0 -42.51 89.63 Favored 'General case' 0 CA--C 1.518 -0.265 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.711 177.339 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . 0.467 ' O ' ' HB2' ' A' ' 578' ' ' LEU . 65.2 t30 -58.33 -43.81 88.39 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.935 0.874 . . . . 0.0 109.328 177.803 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 37.1 m80 -58.29 -48.49 80.29 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.695 -1.139 . . . . 0.0 110.942 175.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -60.15 -35.12 74.59 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-N 115.777 -0.647 . . . . 0.0 111.287 178.26 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.664 HD21 ' HB ' ' A' ' 560' ' ' VAL . 26.6 mt -53.84 -51.98 61.84 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-O 120.599 0.238 . . . . 0.0 111.262 174.262 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.427 ' HD2' ' O ' ' A' ' 575' ' ' ASN . 0.0 OUTLIER -60.74 -44.15 97.02 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 120.768 -0.373 . . . . 0.0 111.226 -179.859 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . 0.59 ' O ' ' HG3' ' A' ' 583' ' ' ARG . 37.0 tt0 -68.04 -53.74 23.51 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 115.665 -0.698 . . . . 0.0 111.728 -178.138 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -60.63 -31.01 70.23 Favored 'General case' 0 C--N 1.316 -0.867 0 N-CA-C 112.417 0.525 . . . . 0.0 112.417 -179.047 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . . . . . . . . 0.266 1.8 m -81.36 -26.45 35.52 Favored 'General case' 0 C--O 1.175 -2.846 0 N-CA-C 113.821 1.045 . . . . 0.0 113.821 179.072 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.59 ' HG3' ' O ' ' A' ' 580' ' ' GLU 0.267 0.0 OUTLIER -56.95 -24.19 50.98 Favored 'General case' 0 CA--C 1.577 1.992 0 CA-C-O 122.981 1.372 . . . . 0.0 112.207 178.156 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . 0.355 12.7 tt -85.43 65.88 0.48 Allowed 'Isoleucine or valine' 0 C--N 1.288 -2.101 0 C-N-CA 129.294 3.037 . . . . 0.0 109.365 167.75 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 144.65 68.78 0.02 OUTLIER Glycine 0 C--N 1.351 1.411 0 CA-C-O 125.165 2.536 . . . . 0.0 107.323 -144.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -52.59 172.95 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.268 1 C-N-CA 132.081 4.152 . . . . 0.0 112.136 -163.808 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.1 p -17.21 -3.34 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.529 3.5 1 C-N-CA 132.409 4.284 . . . . 0.0 119.465 -139.68 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -63.71 -29.33 70.57 Favored 'General case' 0 C--O 1.204 -1.29 0 N-CA-C 103.671 -2.715 . . . . 0.0 103.671 153.798 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . 0.427 ' HG ' ' N ' ' A' ' 590' ' ' GLN . 0.1 OUTLIER -49.98 -47.29 52.85 Favored 'General case' 0 C--O 1.197 -1.664 0 C-N-CA 126.825 2.05 . . . . 0.0 110.304 169.965 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . 0.427 ' N ' ' HG ' ' A' ' 589' ' ' LEU . 50.0 tt0 -57.64 -47.58 81.85 Favored 'General case' 0 CA--C 1.507 -0.711 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 177.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -59.3 -48.12 82.82 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.161 176.232 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -60.29 -40.53 90.79 Favored 'General case' 0 C--N 1.312 -1.033 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 178.107 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 65.5 t80 -60.29 -43.22 96.48 Favored 'General case' 0 C--N 1.316 -0.877 0 C-N-CA 123.429 0.692 . . . . 0.0 110.104 175.087 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.401 ' O ' ' HB ' ' A' ' 597' ' ' ILE . 50.8 tp -60.31 -42.94 96.6 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 122.088 0.947 . . . . 0.0 109.234 175.02 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.519 ' HA ' HG12 ' A' ' 598' ' ' VAL . 26.6 mt-30 -67.66 -26.08 66.03 Favored 'General case' 0 C--N 1.305 -1.338 0 CA-C-N 114.899 -1.046 . . . . 0.0 112.278 178.443 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -68.62 -40.21 80.46 Favored 'General case' 0 C--N 1.322 -0.629 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 174.746 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.401 ' HB ' ' O ' ' A' ' 594' ' ' LEU . 75.8 mt -57.17 -47.72 83.46 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.101 175.009 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . 0.519 HG12 ' HA ' ' A' ' 595' ' ' GLN . 4.3 p -69.64 -28.38 37.29 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.069 0 C-N-CA 120.551 -0.46 . . . . 0.0 111.1 178.712 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.575 ' O ' ' HB3' ' A' ' 602' ' ' LYS . . . -67.22 -37.14 83.11 Favored 'General case' 0 N--CA 1.471 0.606 0 CA-C-O 121.922 0.868 . . . . 0.0 109.766 174.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 58.9 tttm -68.43 -39.03 81.7 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-N 115.199 -0.909 . . . . 0.0 109.316 174.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 45.0 t30 -64.88 -27.82 69.12 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-O 121.973 0.892 . . . . 0.0 110.042 175.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.575 ' HB3' ' O ' ' A' ' 599' ' ' ALA . 3.8 tmtm? -68.41 -49.69 58.15 Favored 'General case' 0 C--N 1.311 -1.099 0 N-CA-C 107.608 -1.256 . . . . 0.0 107.608 174.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . 0.409 ' C ' ' H ' ' A' ' 605' ' ' MET . 47.2 mt-10 -82.71 6.99 16.18 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.154 0.798 . . . . 0.0 113.154 179.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 75.4 ttt180 -71.08 44.65 0.09 Allowed 'General case' 0 CA--C 1.561 1.392 0 CA-C-O 122.858 1.313 . . . . 0.0 110.971 177.539 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . 0.409 ' H ' ' C ' ' A' ' 603' ' ' GLU . 18.1 ptp . . . . . 0 C--N 1.283 -2.313 0 CA-C-N 114.856 -1.066 . . . . 0.0 108.321 179.017 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 32.6 p90 . . . . . 0 C--O 1.247 0.966 0 N-CA-C 114.052 1.13 . . . . 0.0 114.052 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . 0.413 ' C ' HD22 ' A' ' 465' ' ' ASN . 8.4 m-20 -81.83 163.14 22.54 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.772 -0.649 . . . . 0.0 109.984 177.297 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . 0.413 HD22 ' C ' ' A' ' 464' ' ' ASP . 0.8 OUTLIER -127.9 78.39 1.82 Allowed 'General case' 0 C--N 1.305 -1.352 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 -179.53 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 7.1 mp -69.65 99.67 1.35 Allowed 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 177.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 18.4 m -71.06 135.58 47.82 Favored 'General case' 0 C--N 1.293 -1.881 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -174.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 19.6 mmt85 -60.12 -38.79 84.09 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 123.138 1.447 . . . . 0.0 107.199 173.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.572 ' HG3' ' HA ' ' A' ' 563' ' ' ILE . 18.3 mp0 -64.14 -21.76 66.67 Favored 'General case' 0 N--CA 1.422 -1.834 0 CA-C-N 112.768 -2.015 . . . . 0.0 111.555 -178.068 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.66 ' O ' ' HG2' ' A' ' 474' ' ' ARG . 55.3 tt0 -66.28 -40.79 90.32 Favored 'General case' 0 C--O 1.209 -1.047 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 177.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 20.0 tptm -62.58 -41.53 99.0 Favored 'General case' 0 CA--C 1.516 -0.355 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -58.17 -46.26 86.04 Favored 'General case' 0 C--O 1.243 0.738 0 O-C-N 123.675 0.609 . . . . 0.0 109.89 175.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -57.57 -50.29 73.59 Favored 'General case' 0 C--O 1.2 -1.548 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.957 175.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.66 ' HG2' ' O ' ' A' ' 470' ' ' GLU . 18.7 mmm-85 -59.18 -32.0 69.51 Favored 'General case' 0 N--CA 1.477 0.89 0 CA-C-O 120.77 0.319 . . . . 0.0 110.327 -178.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . . . . . . . . . . . -66.02 -57.59 7.41 Favored 'General case' 0 C--N 1.323 -0.557 0 N-CA-C 110.132 -0.322 . . . . 0.0 110.132 176.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . 0.416 ' HB3' ' HB2' ' A' ' 490' ' ' TYR . 1.4 m-85 -62.53 -35.4 79.31 Favored 'General case' 0 CA--C 1.543 0.69 0 N-CA-C 113.686 0.995 . . . . 0.0 113.686 178.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 25.8 tp -73.17 -9.0 58.25 Favored 'General case' 0 C--N 1.312 -1.031 0 C-N-CA 124.941 1.296 . . . . 0.0 112.352 -176.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . . . . . . . . . 52.4 tttp -46.51 -40.04 11.85 Favored 'General case' 0 C--O 1.211 -0.965 0 C-N-CA 124.207 1.003 . . . . 0.0 113.577 -179.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.956 ' HA ' HG21 ' A' ' 486' ' ' THR 0.256 0.3 OUTLIER 84.76 130.15 0.04 OUTLIER 'General case' 0 N--CA 1.487 1.407 0 C-N-CA 126.574 1.949 . . . . 0.0 111.753 -177.153 . . . . . . . . 4 4 . 1 . 017 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -93.42 -96.25 0.15 Allowed 'General case' 0 N--CA 1.427 -1.591 0 C-N-CA 119.816 -0.754 . . . . 0.0 109.406 175.188 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . . . . . . . . 0.398 0.5 OUTLIER -95.84 -91.37 0.22 Allowed 'General case' 0 CA--C 1.472 -2.04 0 N-CA-C 115.814 1.783 . . . . 0.0 115.814 179.905 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . 0.603 ' HB3' ' O ' ' A' ' 519' ' ' ASP . 12.6 mtm180 -79.04 -100.33 0.03 OUTLIER 'General case' 0 N--CA 1.426 -1.668 0 C-N-CA 116.689 -2.004 . . . . 0.0 111.202 -174.405 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . 0.593 ' HB3' ' HB2' ' A' ' 519' ' ' ASP . 10.1 t70 -142.46 -54.72 0.43 Allowed 'General case' 0 C--N 1.296 -1.74 0 C-N-CA 123.453 0.701 . . . . 0.0 109.262 173.927 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 34.3 tttm -34.53 -66.45 0.17 Allowed 'General case' 0 N--CA 1.497 1.887 0 CA-C-N 113.046 -1.888 . . . . 0.0 113.746 -170.43 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 31.8 m-20 -58.95 -52.9 63.79 Favored 'General case' 0 C--O 1.202 -1.442 0 CA-C-N 114.342 -1.299 . . . . 0.0 110.546 -173.364 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.956 HG21 ' HA ' ' A' ' 479' ' ' HIS . 93.8 m -61.03 -48.15 83.09 Favored 'General case' 0 C--N 1.308 -1.226 0 CA-C-N 115.744 -0.662 . . . . 0.0 111.778 -177.902 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 29.5 t80 -54.92 -59.09 5.21 Favored 'General case' 0 N--CA 1.434 -1.27 0 O-C-N 124.431 1.082 . . . . 0.0 108.959 -177.036 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 85.0 mt -68.65 -27.64 66.18 Favored 'General case' 0 C--N 1.309 -1.189 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.421 -178.789 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 74.4 m-20 -64.36 -30.8 71.83 Favored 'General case' 0 CA--C 1.489 -1.375 0 N-CA-C 112.705 0.632 . . . . 0.0 112.705 -179.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . 0.448 ' O ' HG23 ' A' ' 494' ' ' VAL . 2.0 t80 -95.53 -53.43 3.74 Favored 'General case' 1 N--CA 1.367 -4.613 0 N-CA-C 108.365 -0.976 . . . . 0.0 108.365 176.484 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 57.9 t80 -63.96 -40.24 95.95 Favored 'General case' 0 C--N 1.313 -0.989 0 C-N-CA 124.747 1.219 . . . . 0.0 114.146 -167.64 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -81.93 -10.68 59.2 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-O 121.436 0.636 . . . . 0.0 112.17 179.393 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 17.8 m -84.84 -11.76 54.98 Favored 'General case' 0 C--N 1.303 -1.442 0 CA-C-N 115.701 -0.681 . . . . 0.0 110.05 176.209 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . 0.448 HG23 ' O ' ' A' ' 490' ' ' TYR . 23.9 t -113.72 109.39 28.35 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.863 0 CA-C-N 116.375 -0.375 . . . . 0.0 110.256 -176.824 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -95.23 -17.1 22.0 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 107.3 -1.37 . . . . 0.0 107.3 176.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -89.56 20.61 3.86 Favored 'General case' 0 C--N 1.305 -1.333 0 CA-C-N 113.329 -1.76 . . . . 0.0 111.647 179.397 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -58.51 -6.9 0.78 Allowed 'General case' 0 N--CA 1.479 0.979 0 N-CA-C 114.485 1.291 . . . . 0.0 114.485 -174.168 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -79.57 -9.82 59.69 Favored 'General case' 0 C--N 1.312 -1.05 0 O-C-N 120.898 -1.126 . . . . 0.0 110.58 176.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 78.3 t80 -82.22 -9.41 59.51 Favored 'General case' 0 CA--C 1.551 1.018 0 CA-C-N 115.579 -0.737 . . . . 0.0 110.783 176.511 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 20.4 p -56.14 160.91 2.66 Favored 'General case' 0 C--O 1.25 1.103 0 N-CA-C 115.604 1.705 . . . . 0.0 115.604 -174.586 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.712 ' OD1' ' HB2' ' A' ' 503' ' ' HIS . 8.0 p30 -91.64 161.73 14.79 Favored 'General case' 0 N--CA 1.416 -2.145 0 CA-C-N 114.03 -1.441 . . . . 0.0 111.03 179.303 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -77.42 -23.31 50.62 Favored 'General case' 0 N--CA 1.477 0.917 0 CA-C-O 121.571 0.7 . . . . 0.0 109.623 -178.135 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . 0.712 ' HB2' ' OD1' ' A' ' 501' ' ' ASN . 32.3 m170 -61.42 -46.24 90.94 Favored 'General case' 0 C--N 1.302 -1.493 0 N-CA-C 106.942 -1.503 . . . . 0.0 106.942 175.724 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . 0.429 ' CE1' ' CE1' ' A' ' 490' ' ' TYR . 72.2 t80 -57.65 -35.43 70.53 Favored 'General case' 0 N--CA 1.437 -1.108 0 CA-C-N 114.266 -1.334 . . . . 0.0 111.197 173.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -63.93 -48.85 74.94 Favored 'General case' 0 CA--C 1.482 -1.652 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 -175.463 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.495 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.2 OUTLIER -61.32 -37.67 84.09 Favored 'General case' 0 C--N 1.35 0.611 0 C-N-CA 118.283 -1.367 . . . . 0.0 110.17 -179.076 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . 0.462 ' O ' ' HG ' ' A' ' 511' ' ' LEU . 23.3 t -66.85 -54.53 24.12 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.482 0 C-N-CA 120.291 -0.563 . . . . 0.0 110.785 -179.999 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 11.8 t80 -48.97 -39.87 28.23 Favored 'General case' 0 N--CA 1.489 1.483 0 C-N-CA 123.849 0.86 . . . . 0.0 110.873 176.339 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 32.7 tt0 -59.52 -56.34 23.2 Favored 'General case' 0 C--N 1.314 -0.964 0 C-N-CA 124.362 1.065 . . . . 0.0 110.376 -179.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.495 HG23 ' O ' ' A' ' 506' ' ' TYR . 2.5 t -64.44 -41.16 91.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 C-N-CA 120.843 -0.343 . . . . 0.0 110.445 178.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 83.7 mt -58.75 -53.78 54.49 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-O 121.251 0.548 . . . . 0.0 111.488 -177.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -62.82 -32.13 73.27 Favored 'General case' 0 C--O 1.222 -0.362 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.695 -179.714 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -62.32 -40.98 98.12 Favored 'General case' 0 N--CA 1.475 0.777 0 CA-C-O 120.773 0.321 . . . . 0.0 110.254 177.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . 0.446 ' CE2' HG12 ' A' ' 510' ' ' VAL . 33.4 m-85 -69.11 -57.09 5.86 Favored 'General case' 0 CA--C 1.497 -1.089 0 N-CA-C 109.207 -0.664 . . . . 0.0 109.207 176.597 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -49.03 -34.53 13.56 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.893 1.277 . . . . 0.0 111.307 -178.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.06 -23.97 66.63 Favored 'General case' 0 CA--C 1.537 0.446 0 N-CA-C 112.325 0.491 . . . . 0.0 112.325 179.667 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -112.38 -58.01 2.2 Favored 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.45 0.643 . . . . 0.0 110.021 -179.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -158.01 121.54 4.01 Favored 'General case' 0 C--N 1.313 -1.021 0 C-N-CA 125.345 1.458 . . . . 0.0 108.352 175.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . 0.603 ' O ' ' HB3' ' A' ' 482' ' ' ARG . 1.9 p30 -77.78 98.72 5.64 Favored 'General case' 0 C--N 1.297 -1.716 0 CA-C-O 121.064 0.459 . . . . 0.0 111.698 -172.231 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 -143.04 140.97 31.19 Favored 'General case' 0 CA--C 1.491 -1.315 0 O-C-N 121.437 -0.79 . . . . 0.0 110.938 167.826 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 51.3 t80 -85.0 105.9 16.1 Favored 'General case' 0 N--CA 1.402 -2.864 0 N-CA-C 105.802 -1.925 . . . . 0.0 105.802 170.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 41.8 t-20 -85.5 110.41 19.18 Favored 'General case' 0 C--N 1.292 -1.912 0 N-CA-C 108.284 -1.006 . . . . 0.0 108.284 -177.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 5.0 tt -55.85 -33.32 34.43 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.591 0 C-N-CA 124.58 1.152 . . . . 0.0 110.907 -179.651 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.581 ' O ' ' HG3' ' A' ' 528' ' ' GLN . 48.1 t -58.34 -38.64 77.56 Favored 'General case' 0 N--CA 1.424 -1.759 0 CA-C-N 115.329 -0.851 . . . . 0.0 111.083 178.623 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -65.26 -43.57 90.84 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 -178.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.459 ' O ' ' HB2' ' A' ' 529' ' ' TYR . . . -58.11 -52.47 65.43 Favored 'General case' 0 C--O 1.212 -0.881 0 CA-C-N 114.633 -1.167 . . . . 0.0 111.137 179.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.587 ' HA ' HG13 ' A' ' 530' ' ' VAL . 8.9 p -67.77 -24.02 30.24 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.34 0 CA-C-O 121.063 0.459 . . . . 0.0 111.88 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . 0.581 ' HG3' ' O ' ' A' ' 524' ' ' SER . 26.2 mt-30 -67.65 -26.62 66.31 Favored 'General case' 0 C--N 1.326 -0.419 0 O-C-N 121.144 -0.972 . . . . 0.0 109.484 172.879 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.459 ' HB2' ' O ' ' A' ' 526' ' ' ALA . 47.5 m-85 -75.01 -0.49 19.0 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 118.136 -0.935 . . . . 0.0 112.659 174.416 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.637 ' HA ' ' NH1' ' A' ' 536' ' ' ARG . 32.3 m -72.37 20.88 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.532 3.666 0 N-CA-C 116.589 2.07 . . . . 0.0 116.589 -173.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 45.9 m-80 -128.99 -40.5 1.5 Allowed 'General case' 0 C--N 1.278 -2.521 0 N-CA-C 107.557 -1.275 . . . . 0.0 107.557 173.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -77.58 -144.62 0.03 OUTLIER 'General case' 0 C--N 1.279 -2.487 0 C-N-CA 128.729 2.812 . . . . 0.0 112.062 -179.424 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . 0.497 ' C ' ' H ' ' A' ' 535' ' ' LEU . 45.3 t30 -27.8 31.42 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.397 1 C-N-CA 138.496 6.719 . . . . 0.0 117.578 176.817 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -31.76 8.87 0.0 OUTLIER 'General case' 0 N--CA 1.536 3.854 0 C-N-CA 130.992 3.717 . . . . 0.0 117.045 -179.241 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.497 ' H ' ' C ' ' A' ' 533' ' ' ASN . 45.5 mt -63.76 -26.84 68.82 Favored 'General case' 0 C--N 1.283 -2.295 0 N-CA-C 103.167 -2.901 . . . . 0.0 103.167 162.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.637 ' NH1' ' HA ' ' A' ' 530' ' ' VAL . 1.4 ttp180 -56.27 -39.55 72.81 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 111.887 -2.415 . . . . 0.0 110.985 169.094 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -60.96 -47.04 88.28 Favored 'General case' 0 CA--C 1.481 -1.706 0 N-CA-C 107.11 -1.441 . . . . 0.0 107.11 -179.044 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.472 ' O ' HD13 ' A' ' 542' ' ' LEU . 24.4 m -55.81 -48.15 75.91 Favored 'General case' 0 CA--C 1.554 1.102 0 CA-C-N 114.295 -1.32 . . . . 0.0 109.832 174.853 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . 0.552 ' O ' ' HB2' ' A' ' 542' ' ' LEU . 9.3 tt -60.54 -36.71 79.09 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 178.934 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . 0.484 HG12 ' O ' ' A' ' 536' ' ' ARG . 50.1 mm -66.88 -34.27 68.84 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.798 0 N-CA-C 109.43 -0.582 . . . . 0.0 109.43 178.222 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . 0.443 ' HB3' ' O ' ' A' ' 538' ' ' THR . 29.7 t -57.32 -40.01 77.0 Favored 'General case' 0 CA--C 1.56 1.342 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 172.104 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.552 ' HB2' ' O ' ' A' ' 539' ' ' LEU . 6.3 mp -60.58 -33.63 73.0 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.527 0.731 . . . . 0.0 109.955 175.665 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 6.4 mm-40 -80.08 -31.11 39.36 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 177.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -69.71 -33.65 72.8 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.844 -1.169 . . . . 0.0 107.844 175.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 27.4 t80 -64.01 114.05 3.88 Favored 'General case' 0 N--CA 1.437 -1.124 0 CA-C-N 114.57 -1.195 . . . . 0.0 108.256 170.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 11.2 m120 -107.1 138.22 43.68 Favored 'General case' 0 C--N 1.289 -2.063 0 CA-C-N 115.971 -0.559 . . . . 0.0 111.247 -175.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.558 ' H ' HD23 ' A' ' 547' ' ' LEU . 2.1 pt? -79.8 9.5 5.15 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 122.288 1.042 . . . . 0.0 110.511 177.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 36.8 t30 -68.81 -41.41 78.69 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 114.703 -1.135 . . . . 0.0 108.542 174.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.3 m-20 -68.36 -60.52 2.38 Favored 'General case' 0 CA--C 1.505 -0.784 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.744 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -125.21 119.78 25.12 Favored Pre-proline 0 N--CA 1.425 -1.723 0 N-CA-C 108.043 -1.095 . . . . 0.0 108.043 177.276 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . 0.486 ' HB2' ' OE1' ' A' ' 553' ' ' GLU . 29.9 Cg_endo -63.49 -169.91 0.1 Allowed 'Trans proline' 0 CA--C 1.546 1.125 0 C-N-CA 123.233 2.622 . . . . 0.0 114.065 -177.707 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . 0.443 ' O ' HG13 ' A' ' 556' ' ' ILE . 47.1 p90 -91.55 -13.65 31.68 Favored 'General case' 0 CA--C 1.496 -1.103 0 N-CA-C 113.499 0.925 . . . . 0.0 113.499 -170.729 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . 0.486 ' OE1' ' HB2' ' A' ' 551' ' ' PRO . 2.0 mp0 -66.9 -42.86 84.75 Favored 'General case' 0 C--N 1.28 -2.435 0 CA-C-O 121.304 0.573 . . . . 0.0 110.416 -179.655 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . 0.525 ' HA ' ' HG3' ' A' ' 583' ' ' ARG . 1.9 p-10 -69.16 -24.07 64.03 Favored 'General case' 0 CA--C 1.49 -1.365 0 CA-C-N 115.102 -0.954 . . . . 0.0 110.551 175.121 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . 0.46 ' HG3' ' O ' ' A' ' 551' ' ' PRO . 54.9 mt-10 -72.39 -46.78 53.72 Favored 'General case' 0 C--O 1.211 -0.927 0 C-N-CA 120.054 -0.658 . . . . 0.0 109.408 -179.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 552' ' ' TYR . 64.8 mt -58.79 -49.17 83.81 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.641 0 C-N-CA 123.116 0.566 . . . . 0.0 110.865 178.078 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 22.3 t70 -60.31 -52.53 64.88 Favored 'General case' 0 CA--C 1.508 -0.638 0 C-N-CA 120.713 -0.395 . . . . 0.0 111.58 -179.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 38.6 t70 -60.24 -43.35 96.17 Favored 'General case' 0 C--O 1.207 -1.161 0 O-C-N 123.862 0.726 . . . . 0.0 110.611 -178.542 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . 0.442 ' O ' HG13 ' A' ' 563' ' ' ILE . 50.4 t80 -54.43 -53.56 52.47 Favored 'General case' 0 C--N 1.319 -0.731 0 C-N-CA 124.473 1.109 . . . . 0.0 110.813 176.446 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 53.9 t -65.21 -42.33 93.8 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 115.894 -0.594 . . . . 0.0 110.569 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 29.2 t-20 -62.4 -42.43 99.42 Favored 'General case' 0 C--O 1.194 -1.861 0 C-N-CA 123.456 0.702 . . . . 0.0 110.087 -179.273 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . 0.585 ' O ' ' HG2' ' A' ' 565' ' ' GLU . 40.9 t -64.89 -41.21 91.55 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.169 0 CA-C-O 121.656 0.741 . . . . 0.0 112.679 179.479 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.572 ' HA ' ' HG3' ' A' ' 469' ' ' GLN . 54.1 mt -76.32 -35.85 28.3 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.224 0 CA-C-O 122.136 0.969 . . . . 0.0 109.462 -174.778 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -90.93 -6.82 53.58 Favored 'General case' 0 C--N 1.288 -2.08 0 CA-C-N 114.623 -1.172 . . . . 0.0 111.0 -176.728 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.585 ' HG2' ' O ' ' A' ' 562' ' ' VAL . 11.8 pt-20 -76.6 -25.03 53.48 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.136 -1.061 . . . . 0.0 108.136 178.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt -90.06 12.52 17.48 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.025 -0.989 . . . . 0.0 110.325 176.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -121.22 -55.59 0.23 Allowed Glycine 0 N--CA 1.431 -1.668 0 CA-C-N 115.54 -0.755 . . . . 0.0 112.286 -179.138 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 99.5 mt-30 -87.05 157.35 19.44 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 114.165 1.172 . . . . 0.0 114.165 -175.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . 0.54 ' HG3' ' H ' ' A' ' 571' ' ' ILE . 9.8 tp10 -60.7 171.16 1.22 Allowed 'General case' 0 CA--C 1.58 2.133 0 C-N-CA 126.458 1.903 . . . . 0.0 113.36 -177.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . . . . . . . . . 36.2 m -78.04 -10.99 59.87 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 124.543 1.137 . . . . 0.0 110.319 -178.606 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.54 ' H ' ' HG3' ' A' ' 569' ' ' GLU . 5.0 mt -86.5 -31.34 6.24 Favored 'Isoleucine or valine' 0 CA--C 1.479 -1.763 0 N-CA-C 105.772 -1.936 . . . . 0.0 105.772 177.096 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -71.11 -22.2 62.12 Favored 'General case' 0 N--CA 1.4 -2.928 0 CA-C-N 113.584 -1.643 . . . . 0.0 110.389 174.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 52.3 m -61.7 -34.13 75.22 Favored 'General case' 0 CA--C 1.547 0.84 0 CA-C-N 116.802 -0.181 . . . . 0.0 110.709 177.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . . . . . . . . . 7.3 mp -65.11 -47.0 78.72 Favored 'General case' 0 N--CA 1.465 0.276 0 N-CA-C 109.465 -0.568 . . . . 0.0 109.465 173.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 40.2 t30 -60.15 -40.29 89.33 Favored 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 115.344 -0.844 . . . . 0.0 110.434 178.198 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 9.2 m170 -57.89 -40.41 80.21 Favored 'General case' 0 C--O 1.197 -1.689 0 CA-C-N 115.911 -0.586 . . . . 0.0 110.424 174.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . 0.45 ' O ' ' HB3' ' A' ' 580' ' ' GLU . 40.2 ttmt -63.27 -49.44 74.06 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 123.103 0.561 . . . . 0.0 111.983 -177.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 8.7 mp -62.19 -43.76 98.1 Favored 'General case' 0 N--CA 1.479 0.997 0 CA-C-O 121.231 0.538 . . . . 0.0 111.484 175.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.694 ' O ' ' HB ' ' A' ' 582' ' ' THR . 12.3 ttm105 -59.7 -34.32 72.75 Favored 'General case' 0 CA--C 1.565 1.553 0 CA-C-O 121.8 0.81 . . . . 0.0 110.73 174.534 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . 0.45 ' HB3' ' O ' ' A' ' 577' ' ' LYS . 32.3 tt0 -64.64 -33.41 75.87 Favored 'General case' 0 C--O 1.197 -1.691 0 CA-C-N 115.47 -0.786 . . . . 0.0 109.494 177.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -67.42 -35.35 79.08 Favored 'General case' 0 C--N 1.313 -0.988 0 CA-C-O 121.442 0.639 . . . . 0.0 110.58 172.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.694 ' HB ' ' O ' ' A' ' 579' ' ' ARG . 54.4 m -60.33 -28.42 68.14 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 125.201 1.401 . . . . 0.0 111.192 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.525 ' HG3' ' HA ' ' A' ' 554' ' ' ASN . 25.4 ttm180 -30.25 -34.41 0.01 OUTLIER 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 127.594 2.358 . . . . 0.0 116.831 176.224 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 13.4 tt -74.36 -10.31 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.585 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -171.603 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 87.95 8.58 72.35 Favored Glycine 0 N--CA 1.477 1.396 0 C-N-CA 120.209 -0.996 . . . . 0.0 112.417 177.049 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -83.69 166.75 17.83 Favored 'General case' 0 C--N 1.284 -2.251 0 C-N-CA 125.45 1.5 . . . . 0.0 110.025 179.197 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.575 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 19.9 m -46.92 -6.76 0.01 OUTLIER 'Isoleucine or valine' 0 C--N 1.36 1.03 0 C-N-CA 125.942 1.697 . . . . 0.0 114.172 177.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -62.32 -11.78 17.22 Favored 'General case' 0 CA--C 1.562 1.419 0 O-C-N 121.562 -0.711 . . . . 0.0 110.423 166.31 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . 0.496 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 9.3 mp -68.91 -36.79 78.43 Favored 'General case' 0 N--CA 1.481 1.085 0 N-CA-C 109.186 -0.672 . . . . 0.0 109.186 167.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . 0.575 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 32.9 tt0 -60.58 -40.09 90.44 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 107.771 -1.196 . . . . 0.0 107.771 171.848 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . . . . . . . . . 54.2 tttp -69.14 -27.22 65.36 Favored 'General case' 0 C--O 1.207 -1.18 0 CA-C-N 114.462 -1.245 . . . . 0.0 110.314 177.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.496 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 62.8 t80 -61.24 -41.65 97.26 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 120.993 0.425 . . . . 0.0 109.875 173.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . 0.426 ' O ' ' HB3' ' A' ' 596' ' ' GLN . 71.8 t80 -58.88 -42.71 90.13 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 174.336 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 60.7 tp -61.54 -41.86 97.97 Favored 'General case' 0 C--O 1.204 -1.326 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.407 175.42 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 15.6 mm100 -61.92 -29.27 70.11 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.576 0.75 . . . . 0.0 111.947 178.856 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . 0.426 ' HB3' ' O ' ' A' ' 593' ' ' TYR . 35.5 tt0 -63.67 -52.81 59.01 Favored 'General case' 0 C--O 1.248 1.012 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 173.897 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 1.8 mp -58.93 -47.68 88.92 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.877 0 CA-C-N 114.834 -1.075 . . . . 0.0 111.339 175.417 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 71.1 t -60.62 -42.87 93.36 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.498 0 C-N-CA 123.206 0.603 . . . . 0.0 111.499 -178.747 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.427 ' O ' ' HE2' ' A' ' 602' ' ' LYS . . . -60.81 -37.37 81.75 Favored 'General case' 0 C--N 1.325 -0.463 0 CA-C-O 120.862 0.363 . . . . 0.0 110.279 177.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -68.39 -41.41 80.55 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 116.36 -0.382 . . . . 0.0 110.93 176.229 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . 0.544 ' O ' ' HB3' ' A' ' 604' ' ' ARG . 67.1 t30 -66.01 -34.24 77.65 Favored 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 122.225 1.012 . . . . 0.0 109.984 178.698 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.548 ' HE3' ' HG3' ' A' ' 603' ' ' GLU . 12.4 ttpt -65.42 -44.26 87.96 Favored 'General case' 0 C--N 1.307 -1.243 0 CA-C-N 114.713 -1.131 . . . . 0.0 109.158 177.618 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . 0.548 ' HG3' ' HE3' ' A' ' 602' ' ' LYS . 13.2 mt-10 -79.22 -6.87 57.61 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.727 0.811 . . . . 0.0 112.471 176.227 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . 0.544 ' HB3' ' O ' ' A' ' 601' ' ' ASN . 62.7 ttt180 -77.69 -55.95 4.92 Favored 'General case' 0 C--N 1.305 -1.333 0 C-N-CA 123.746 0.818 . . . . 0.0 111.147 177.28 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 68.1 mtm . . . . . 0 C--N 1.308 -1.218 0 CA-C-O 118.605 -0.712 . . . . 0.0 110.265 -176.38 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 . . . . . 0 N--CA 1.434 -1.272 0 CA-C-O 121.59 0.709 . . . . 0.0 111.441 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 11.4 p-10 -118.37 -141.69 0.36 Allowed 'General case' 0 C--N 1.294 -1.824 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -179.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 5.2 m-20 -81.28 -134.02 0.03 OUTLIER 'General case' 0 N--CA 1.414 -2.247 0 N-CA-C 107.425 -1.324 . . . . 0.0 107.425 178.017 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . 0.424 ' H ' ' HG ' ' A' ' 466' ' ' LEU . 50.5 mt -48.16 129.0 14.86 Favored 'General case' 0 C--N 1.293 -1.881 0 C-N-CA 125.447 1.499 . . . . 0.0 110.311 -176.79 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 68.8 p -75.05 178.64 5.51 Favored 'General case' 0 C--N 1.286 -2.172 0 CA-C-N 115.264 -0.88 . . . . 0.0 112.125 -175.064 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . 0.463 ' NH2' HG22 ' A' ' 562' ' ' VAL . 8.1 ptm85 -60.18 -40.94 91.77 Favored 'General case' 0 C--N 1.326 -0.413 0 N-CA-C 113.053 0.76 . . . . 0.0 113.053 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.54 ' NE2' ' HA ' ' A' ' 563' ' ' ILE . 67.0 mt-30 -70.36 -30.02 66.84 Favored 'General case' 0 C--O 1.212 -0.88 0 C-N-CA 119.041 -1.064 . . . . 0.0 111.429 176.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.533 ' HG2' HG22 ' A' ' 500' ' ' THR . 48.5 mt-10 -70.72 -35.19 72.61 Favored 'General case' 0 CA--C 1.502 -0.879 0 CA-C-O 120.777 0.323 . . . . 0.0 111.104 176.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.489 ' HD3' ' HA ' ' A' ' 471' ' ' LYS . 20.5 mmtp -66.93 -33.45 75.61 Favored 'General case' 0 CA--C 1.495 -1.16 0 CA-C-N 116.135 -0.484 . . . . 0.0 110.834 173.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -71.0 -47.17 60.35 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.91 178.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . 0.404 ' OE2' HG21 ' A' ' 494' ' ' VAL . 5.0 mm-40 -61.44 -44.44 97.1 Favored 'General case' 0 C--O 1.24 0.573 0 CA-C-O 120.515 0.198 . . . . 0.0 110.617 176.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.497 ' NE ' ' HB3' ' A' ' 542' ' ' LEU . 11.7 tpt180 -54.88 -42.23 71.84 Favored 'General case' 0 CA--C 1.542 0.661 0 C-N-CA 120.303 -0.559 . . . . 0.0 110.778 173.887 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . 0.455 ' HA ' ' HE3' ' A' ' 478' ' ' LYS . . . -64.43 -44.93 89.64 Favored 'General case' 0 C--O 1.247 0.951 0 CA-C-O 120.799 0.333 . . . . 0.0 110.692 -179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -64.24 -18.69 64.78 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 179.036 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 69.2 mt -71.08 -15.96 62.55 Favored 'General case' 0 C--N 1.316 -0.878 0 O-C-N 121.953 -0.467 . . . . 0.0 112.07 176.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.455 ' HE3' ' HA ' ' A' ' 475' ' ' ALA . 10.0 mtmp? -77.78 26.15 0.19 Allowed 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 122.984 0.514 . . . . 0.0 111.747 179.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.0 p-80 -86.88 14.0 8.03 Favored 'General case' 0 C--N 1.315 -0.908 0 C-N-CA 122.881 0.472 . . . . 0.0 111.959 -175.164 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . . . . . . . . . 97.1 mt 71.35 -174.55 0.17 Allowed 'General case' 0 C--O 1.245 0.863 0 C-N-CA 123.754 0.821 . . . . 0.0 110.729 -177.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 59.0 ttp -88.26 -36.31 16.79 Favored 'General case' 0 C--N 1.301 -1.519 0 CA-C-N 115.823 -0.626 . . . . 0.0 109.86 -178.034 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 25.2 ttp180 -57.48 -46.67 83.43 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 124.914 1.286 . . . . 0.0 114.313 -173.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -71.3 59.29 0.27 Allowed 'General case' 0 C--N 1.28 -2.422 0 N-CA-C 115.674 1.731 . . . . 0.0 115.674 -171.59 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -57.55 -36.76 72.06 Favored 'General case' 0 C--N 1.316 -0.859 0 C-N-CA 124.319 1.047 . . . . 0.0 111.54 177.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 3.4 p30 -57.19 -44.05 83.24 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-O 121.117 0.484 . . . . 0.0 109.702 176.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 28.9 m -64.6 -31.63 72.93 Favored 'General case' 0 N--CA 1.421 -1.911 0 CA-C-N 115.261 -0.881 . . . . 0.0 111.231 -178.981 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -61.03 -50.93 71.33 Favored 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.02 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . 0.467 ' O ' ' HG2' ' A' ' 492' ' ' GLU . 76.1 mt -74.33 -36.75 63.68 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 120.652 -0.419 . . . . 0.0 110.514 -179.275 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 6.7 t30 -61.32 -42.96 99.54 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.276 0.63 . . . . 0.0 112.431 -176.413 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.3 OUTLIER -78.57 -38.58 39.91 Favored 'General case' 0 N--CA 1.439 -0.984 0 C-N-CA 119.225 -0.99 . . . . 0.0 108.636 179.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -55.19 -49.28 72.31 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.589 -0.732 . . . . 0.0 112.82 178.647 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . 0.467 ' HG2' ' O ' ' A' ' 488' ' ' LEU . 12.6 pt-20 -79.29 -7.69 58.49 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 113.245 0.831 . . . . 0.0 113.245 -177.769 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 68.9 m -81.4 -14.88 56.65 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 122.121 0.962 . . . . 0.0 109.132 174.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . 0.578 HG13 ' HB2' ' A' ' 497' ' ' ASP . 33.1 t -100.08 133.78 41.89 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.441 0 CA-C-N 114.245 -1.343 . . . . 0.0 109.376 -179.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -149.5 -56.63 0.19 Allowed 'General case' 0 C--N 1.31 -1.146 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 177.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 58.7 mmtt -88.46 -22.38 23.71 Favored 'General case' 0 C--N 1.322 -0.63 0 CA-C-O 122.727 1.251 . . . . 0.0 108.347 178.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . 0.578 ' HB2' HG13 ' A' ' 494' ' ' VAL . 0.0 OUTLIER -72.96 -2.88 22.73 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 126.689 1.996 . . . . 0.0 109.365 178.191 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 25.3 t-20 -77.68 22.51 0.26 Allowed 'General case' 0 N--CA 1.482 1.127 0 C-N-CA 124.147 0.979 . . . . 0.0 109.855 -176.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . 0.476 ' HE1' ' OE1' ' A' ' 469' ' ' GLN . 31.5 p90 -77.68 -9.75 59.15 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 108.216 -1.031 . . . . 0.0 108.216 176.665 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . 0.533 HG22 ' HG2' ' A' ' 470' ' ' GLU . 1.1 p -54.48 166.97 0.37 Allowed 'General case' 0 N--CA 1.426 -1.661 0 C-N-CA 125.999 1.72 . . . . 0.0 115.115 -173.959 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.453 ' HB2' ' OE2' ' A' ' 470' ' ' GLU . 16.0 t-20 -64.38 146.99 53.57 Favored 'General case' 0 N--CA 1.429 -1.511 0 CA-C-N 114.184 -1.371 . . . . 0.0 110.024 -175.042 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -64.05 -15.43 59.47 Favored 'General case' 0 C--O 1.208 -1.08 0 CA-C-O 120.97 0.414 . . . . 0.0 111.306 -177.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . 0.695 ' CE1' ' HG ' ' A' ' 535' ' ' LEU . 4.2 m-70 -65.54 -39.03 91.28 Favored 'General case' 0 C--O 1.203 -1.36 0 CA-C-N 115.906 -0.588 . . . . 0.0 110.448 176.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -63.89 -36.62 84.54 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.508 0.67 . . . . 0.0 110.32 176.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 32.6 ttpt -68.11 -41.33 81.91 Favored 'General case' 0 N--CA 1.438 -1.036 0 CA-C-N 115.019 -0.991 . . . . 0.0 108.783 176.545 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . 0.459 ' O ' HG23 ' A' ' 510' ' ' VAL . 0.0 OUTLIER -60.81 -40.37 92.45 Favored 'General case' 0 N--CA 1.436 -1.13 0 CA-C-N 115.427 -0.806 . . . . 0.0 110.19 177.29 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . 0.464 ' O ' HD13 ' A' ' 511' ' ' LEU . 77.1 t -56.42 -56.47 13.48 Favored 'Isoleucine or valine' 0 C--N 1.341 0.217 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 173.622 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -45.62 -52.53 10.54 Favored 'General case' 0 CA--C 1.54 0.569 0 O-C-N 123.96 0.787 . . . . 0.0 111.747 174.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -57.47 -60.09 4.17 Favored 'General case' 0 C--N 1.321 -0.64 0 C-N-CA 123.812 0.845 . . . . 0.0 112.539 -177.934 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . 0.459 HG23 ' O ' ' A' ' 506' ' ' TYR . 17.0 t -60.78 -43.71 95.9 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.752 0 CA-C-O 120.512 0.196 . . . . 0.0 110.99 -176.327 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.464 HD13 ' O ' ' A' ' 507' ' ' VAL . 10.8 mp -63.32 -49.66 73.08 Favored 'General case' 0 N--CA 1.437 -1.114 0 CA-C-N 115.975 -0.557 . . . . 0.0 111.062 -178.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -64.18 -35.9 82.29 Favored 'General case' 0 C--N 1.323 -0.55 0 O-C-N 123.86 0.725 . . . . 0.0 110.856 -177.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 35.0 t70 -60.98 -44.28 97.6 Favored 'General case' 0 C--N 1.322 -0.622 0 CA-C-O 120.822 0.344 . . . . 0.0 111.523 179.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 37.2 m-85 -74.48 -47.21 34.64 Favored 'General case' 0 C--O 1.183 -2.409 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 177.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . 0.402 ' HB2' ' O ' ' A' ' 511' ' ' LEU . 14.6 t80 -47.83 -37.41 13.75 Favored 'General case' 0 C--N 1.314 -0.948 0 C-N-CA 125.674 1.59 . . . . 0.0 110.777 -179.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -66.56 -40.09 88.84 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.933 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 -115.87 -40.6 3.31 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -172.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 22.5 t-20 -106.02 -151.57 0.46 Allowed 'General case' 0 C--N 1.271 -2.83 0 N-CA-C 107.233 -1.395 . . . . 0.0 107.233 -173.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . 0.403 ' CG ' ' H ' ' A' ' 520' ' ' GLN . 13.7 t70 -105.17 -160.11 0.74 Allowed 'General case' 0 C--N 1.285 -2.228 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -177.331 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . 0.403 ' H ' ' CG ' ' A' ' 519' ' ' ASP . 88.2 mt-30 -78.04 166.86 22.3 Favored 'General case' 0 C--N 1.296 -1.753 0 C-N-CA 123.164 0.585 . . . . 0.0 112.359 -174.147 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 56.1 t80 -90.07 134.38 34.29 Favored 'General case' 0 N--CA 1.434 -1.271 0 C-N-CA 125.314 1.445 . . . . 0.0 111.511 -172.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -119.14 176.24 5.4 Favored 'General case' 0 C--N 1.31 -1.128 0 CA-C-N 116.395 -0.366 . . . . 0.0 110.105 177.455 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . 0.601 HD13 ' H ' ' A' ' 523' ' ' ILE 0.303 0.2 OUTLIER -78.95 -14.16 13.56 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 C-N-CA 119.25 -0.98 . . . . 0.0 113.379 -175.859 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 40.9 m -60.37 -36.0 77.03 Favored 'General case' 0 CA--C 1.554 1.106 0 CA-C-O 121.228 0.537 . . . . 0.0 109.589 169.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -66.03 -43.32 87.92 Favored 'General case' 0 C--O 1.253 1.286 0 CA-C-O 122.362 1.077 . . . . 0.0 108.207 176.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.465 ' O ' ' HD3' ' A' ' 536' ' ' ARG . . . -56.15 -52.54 64.01 Favored 'General case' 0 N--CA 1.441 -0.896 0 CA-C-N 113.675 -1.602 . . . . 0.0 111.658 179.619 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.694 ' O ' HG12 ' A' ' 530' ' ' VAL . 8.0 p -64.46 -30.67 50.83 Favored 'Isoleucine or valine' 0 C--O 1.192 -1.928 0 CA-C-O 120.546 0.212 . . . . 0.0 111.026 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 81.3 mm-40 -66.83 -22.94 65.99 Favored 'General case' 0 C--N 1.326 -0.43 0 O-C-N 121.404 -0.81 . . . . 0.0 110.474 176.05 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -78.14 -3.18 41.18 Favored 'General case' 0 N--CA 1.441 -0.916 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 174.543 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.694 HG12 ' O ' ' A' ' 527' ' ' VAL 0.267 8.9 p -74.67 53.84 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.565 1.553 0 CA-C-O 122.918 1.342 . . . . 0.0 113.267 179.039 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 90.6 m-20 -107.16 -33.99 7.27 Favored 'General case' 0 C--N 1.309 -1.16 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 178.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 14.7 t -91.77 109.23 20.55 Favored 'General case' 0 N--CA 1.421 -1.893 0 N-CA-C 102.278 -3.23 . . . . 0.0 102.278 163.772 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . . . . . . . . . 20.5 m120 -62.62 -68.2 0.35 Allowed 'General case' 0 C--O 1.203 -1.369 0 N-CA-C 113.234 0.828 . . . . 0.0 113.234 -170.328 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -49.27 -37.44 23.71 Favored 'General case' 0 N--CA 1.483 1.187 0 N-CA-C 114.398 1.259 . . . . 0.0 114.398 -177.738 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.695 ' HG ' ' CE1' ' A' ' 503' ' ' HIS . 6.6 tt -62.06 -68.01 0.36 Allowed 'General case' 0 C--O 1.266 1.928 0 C-N-CA 124.19 0.996 . . . . 0.0 109.897 179.607 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.465 ' HD3' ' O ' ' A' ' 526' ' ' ALA . 3.7 tpm_? -69.86 -31.29 69.05 Favored 'General case' 0 N--CA 1.412 -2.33 0 CA-C-N 115.091 -0.959 . . . . 0.0 111.843 -175.9 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 9.0 tp10 -56.06 -58.34 8.35 Favored 'General case' 0 CA--C 1.511 -0.545 0 O-C-N 123.9 0.75 . . . . 0.0 110.056 -179.434 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 75.5 m -56.38 -49.04 75.58 Favored 'General case' 0 N--CA 1.443 -0.808 0 O-C-N 123.484 0.49 . . . . 0.0 111.018 178.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 20.1 tp -62.73 -32.81 74.0 Favored 'General case' 0 CA--C 1.568 1.648 0 C-N-CA 119.175 -1.01 . . . . 0.0 111.837 -179.725 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 24.1 mm -68.39 -41.39 83.41 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.071 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 174.817 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 19.5 m -55.35 -48.65 73.91 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.593 0.711 . . . . 0.0 109.597 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.497 ' HB3' ' NE ' ' A' ' 474' ' ' ARG . 7.8 mp -66.5 -19.69 65.85 Favored 'General case' 0 CA--C 1.547 0.828 0 CA-C-N 114.625 -1.171 . . . . 0.0 112.112 178.07 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -87.89 -35.34 17.78 Favored 'General case' 0 C--N 1.326 -0.45 0 C-N-CA 122.766 0.426 . . . . 0.0 111.927 175.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . . . . . . . . . 23.9 tp60 -69.46 -40.51 77.1 Favored 'General case' 0 N--CA 1.444 -0.774 0 CA-C-N 116.058 -0.519 . . . . 0.0 110.163 -177.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 32.4 m-85 -72.06 115.92 11.85 Favored 'General case' 0 N--CA 1.431 -1.389 0 CA-C-O 121.552 0.691 . . . . 0.0 111.591 173.944 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -98.31 93.67 6.34 Favored 'General case' 0 C--N 1.295 -1.783 0 CA-C-N 115.161 -0.927 . . . . 0.0 110.607 -172.07 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . . . . . . . . . 6.6 mp -83.0 -17.22 44.15 Favored 'General case' 0 C--N 1.304 -1.403 0 CA-C-N 115.367 -0.833 . . . . 0.0 110.775 177.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -77.16 9.17 3.25 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 114.613 1.338 . . . . 0.0 114.613 -176.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -69.84 -21.99 63.32 Favored 'General case' 0 CA--C 1.495 -1.149 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 168.046 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . . . . . . . . . 14.4 tp10 -88.11 121.49 70.5 Favored Pre-proline 0 N--CA 1.411 -2.395 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 176.795 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.02 105.54 0.17 Allowed 'Trans proline' 0 N--CA 1.458 -0.584 0 C-N-CA 122.151 1.901 . . . . 0.0 108.623 173.466 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . 0.655 ' HB2' ' HB3' ' A' ' 555' ' ' GLU . 4.2 p90 -77.25 40.11 0.26 Allowed 'General case' 0 C--N 1.315 -0.93 0 N-CA-C 116.411 2.004 . . . . 0.0 116.411 -168.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 50.2 mt-10 -68.82 -48.04 64.56 Favored 'General case' 0 C--N 1.266 -3.046 0 CA-C-N 115.997 -0.547 . . . . 0.0 110.603 -179.414 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . . . . . . . . . 26.2 t-20 -69.07 -27.22 65.43 Favored 'General case' 0 CA--C 1.503 -0.863 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 177.736 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . 0.655 ' HB3' ' HB2' ' A' ' 552' ' ' TYR . 29.6 tt0 -68.85 -38.39 79.76 Favored 'General case' 0 C--O 1.193 -1.894 0 CA-C-N 114.973 -1.012 . . . . 0.0 109.237 -177.238 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . 0.593 HG13 ' O ' ' A' ' 552' ' ' TYR . 62.5 mt -64.52 -45.57 95.26 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.332 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 176.149 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . . . . . . . . . 35.2 t70 -59.57 -43.24 93.67 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-O 120.887 0.375 . . . . 0.0 110.686 178.249 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . 0.571 ' O ' HG23 ' A' ' 562' ' ' VAL . 27.5 t70 -62.54 -55.24 29.2 Favored 'General case' 0 C--O 1.212 -0.908 0 CA-C-N 115.384 -0.825 . . . . 0.0 109.812 175.165 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . 0.437 ' O ' HG12 ' A' ' 563' ' ' ILE . 40.6 t80 -48.28 -53.02 18.73 Favored 'General case' 0 CA--C 1.506 -0.736 0 C-N-CA 125.426 1.49 . . . . 0.0 110.759 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 48.6 t -55.99 -50.98 66.32 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.798 0 O-C-N 124.04 0.837 . . . . 0.0 109.524 178.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.546 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 3.8 t-20 -57.95 -42.77 85.64 Favored 'General case' 0 C--O 1.193 -1.915 0 CA-C-N 117.788 0.267 . . . . 0.0 110.812 179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 558' ' ' ASP . 99.1 t -62.47 -36.39 74.66 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.332 0 C-N-CA 124.031 0.933 . . . . 0.0 112.403 -178.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.54 ' HA ' ' NE2' ' A' ' 469' ' ' GLN . 50.8 mm -88.08 -41.86 14.58 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.929 0 N-CA-C 106.725 -1.583 . . . . 0.0 106.725 -173.666 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . 0.434 HD21 ' CG ' ' A' ' 572' ' ' GLU . 66.3 t30 -85.38 18.02 2.88 Favored 'General case' 0 N--CA 1.423 -1.789 0 CA-C-N 112.946 -1.934 . . . . 0.0 110.274 -176.534 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.546 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 51.6 mt-10 -72.65 -16.05 61.71 Favored 'General case' 0 C--N 1.356 0.857 0 N-CA-C 105.199 -2.149 . . . . 0.0 105.199 165.846 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 59.8 mttp -95.45 25.71 4.29 Favored 'General case' 0 CA--C 1.543 0.683 0 CA-C-N 113.444 -1.707 . . . . 0.0 109.942 174.088 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -137.61 -66.91 0.05 OUTLIER Glycine 0 N--CA 1.445 -0.719 0 N-CA-C 110.446 -1.062 . . . . 0.0 110.446 177.839 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 97.1 mt-30 70.77 157.93 0.18 Allowed 'General case' 0 CA--C 1.55 0.945 0 C-N-CA 124.826 1.25 . . . . 0.0 113.938 176.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -69.18 104.99 2.33 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 114.609 1.337 . . . . 0.0 114.609 -173.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . 0.454 HG23 ' H ' ' A' ' 571' ' ' ILE . 5.4 t -165.72 -54.35 0.03 OUTLIER 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 105.539 -2.023 . . . . 0.0 105.539 175.125 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.454 ' H ' HG23 ' A' ' 570' ' ' THR . 4.8 tp -93.01 -38.43 9.95 Favored 'Isoleucine or valine' 0 N--CA 1.424 -1.749 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 168.214 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . 0.434 ' CG ' HD21 ' A' ' 564' ' ' ASN . 44.5 mm-40 -68.68 -13.1 62.15 Favored 'General case' 0 CA--C 1.507 -0.704 0 CA-C-N 114.179 -1.373 . . . . 0.0 112.924 -178.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . 0.457 ' O ' ' HD2' ' A' ' 577' ' ' LYS . 15.2 p -64.33 -38.54 91.41 Favored 'General case' 0 N--CA 1.418 -2.039 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 175.821 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.6 ' HA ' ' HG3' ' A' ' 602' ' ' LYS . 7.0 mp -62.3 -49.75 74.39 Favored 'General case' 0 CA--C 1.498 -1.043 0 CA-C-O 122.72 1.248 . . . . 0.0 110.605 176.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . 0.665 ' O ' ' HB3' ' A' ' 578' ' ' LEU . 54.0 t30 -62.96 -31.42 72.53 Favored 'General case' 0 C--N 1.247 -3.881 0 CA-C-N 113.186 -1.825 . . . . 0.0 111.131 178.546 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . 0.37 24.2 m170 -63.75 -31.82 73.12 Favored 'General case' 0 C--N 1.287 -2.14 0 O-C-N 120.157 -1.59 . . . . 0.0 112.507 168.63 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . 0.628 ' O ' ' HB3' ' A' ' 580' ' ' GLU . 0.9 OUTLIER -66.92 -24.72 66.12 Favored 'General case' 0 N--CA 1.495 1.782 0 CA-C-O 121.447 0.641 . . . . 0.0 110.892 171.391 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.665 ' HB3' ' O ' ' A' ' 575' ' ' ASN . 3.4 tm? -57.13 -45.81 83.21 Favored 'General case' 0 C--N 1.309 -1.18 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 168.137 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.442 ' HB3' ' OE1' ' A' ' 588' ' ' GLU . 24.5 mtp85 -60.46 -29.2 68.89 Favored 'General case' 0 N--CA 1.496 1.852 0 CA-C-O 121.693 0.759 . . . . 0.0 112.742 175.094 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . 0.628 ' HB3' ' O ' ' A' ' 577' ' ' LYS . 1.7 tm-20 -57.76 -42.79 84.72 Favored 'General case' 0 C--N 1.299 -1.625 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 174.534 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -65.45 -31.62 72.8 Favored 'General case' 0 CA--C 1.561 1.387 0 CA-C-O 121.403 0.621 . . . . 0.0 111.701 171.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.507 ' C ' ' H ' ' A' ' 584' ' ' ILE . 23.8 m -61.74 -22.45 65.4 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 126.344 1.857 . . . . 0.0 112.582 178.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.535 ' HA ' ' HB2' ' A' ' 588' ' ' GLU . 12.6 ptp180 -41.44 7.86 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.209 0 N-CA-C 115.906 1.817 . . . . 0.0 115.906 172.923 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.507 ' H ' ' C ' ' A' ' 582' ' ' THR . 31.7 pt -77.52 12.89 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.532 0 C-N-CA 124.909 1.284 . . . . 0.0 112.263 -178.03 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 129.92 6.53 4.01 Favored Glycine 0 N--CA 1.477 1.404 0 C-N-CA 119.469 -1.348 . . . . 0.0 115.242 171.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . 0.603 ' C ' ' H ' ' A' ' 588' ' ' GLU . 35.2 t0 -85.01 167.98 15.35 Favored 'General case' 0 C--N 1.291 -1.947 0 N-CA-C 106.549 -1.649 . . . . 0.0 106.549 169.755 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.52 ' O ' ' HB3' ' A' ' 590' ' ' GLN . 6.1 t -54.35 16.9 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.584 2.254 0 C-N-CA 128.636 2.774 . . . . 0.0 112.299 -176.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.603 ' H ' ' C ' ' A' ' 586' ' ' ASP . 24.0 mm-40 -65.29 6.16 0.31 Allowed 'General case' 0 C--N 1.27 -2.859 0 C-N-CA 126.361 1.864 . . . . 0.0 114.05 -175.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . 0.482 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 58.5 tp -76.92 -42.47 39.31 Favored 'General case' 0 C--O 1.265 1.909 0 N-CA-C 105.989 -1.856 . . . . 0.0 105.989 166.011 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . 0.52 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 35.6 tt0 -56.63 -49.42 75.04 Favored 'General case' 0 N--CA 1.442 -0.855 0 CA-C-N 112.986 -1.916 . . . . 0.0 107.765 173.531 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.458 ' HB2' ' HA ' ' A' ' 588' ' ' GLU . 0.2 OUTLIER -78.21 -17.64 56.49 Favored 'General case' 0 C--O 1.201 -1.46 0 CA-C-N 114.648 -1.16 . . . . 0.0 111.27 178.415 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.508 ' HA ' ' HG3' ' A' ' 595' ' ' GLN . 88.0 t80 -56.37 -44.52 80.25 Favored 'General case' 0 CA--C 1.478 -1.789 0 C-N-CA 123.604 0.761 . . . . 0.0 109.193 179.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . 0.535 ' O ' HD13 ' A' ' 597' ' ' ILE . 73.6 t80 -57.38 -51.47 69.26 Favored 'General case' 0 CA--C 1.552 1.028 0 CA-C-N 115.199 -0.91 . . . . 0.0 109.463 175.639 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -58.5 -42.56 87.9 Favored 'General case' 0 C--O 1.251 1.155 0 CA-C-O 122.497 1.141 . . . . 0.0 111.575 -178.581 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.526 HE21 ' C ' ' A' ' 595' ' ' GLN 0.301 0.0 OUTLIER -75.06 -42.62 56.54 Favored 'General case' 0 C--O 1.158 -3.726 0 CA-C-O 117.596 -1.192 . . . . 0.0 112.854 -177.073 . . . . . . . . 4 4 . 1 . 018 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 79.5 mm-40 -63.59 -47.87 79.7 Favored 'General case' 0 CA--C 1.495 -1.171 0 CA-C-N 119.31 0.959 . . . . 0.0 111.468 -176.732 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.535 HD13 ' O ' ' A' ' 593' ' ' TYR . 1.8 mp -57.19 -61.09 1.39 Allowed 'Isoleucine or valine' 0 C--O 1.27 2.181 0 CA-C-O 122.909 1.338 . . . . 0.0 110.193 178.203 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . 0.523 ' HB ' ' HZ1' ' A' ' 577' ' ' LYS . 45.3 t -72.1 -17.03 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.412 -2.339 0 CA-C-N 115.099 -0.955 . . . . 0.0 111.858 -175.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.457 ' HA ' ' HD3' ' A' ' 577' ' ' LYS . . . -63.0 -41.97 99.73 Favored 'General case' 0 CA--C 1.468 -2.206 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 175.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . 0.676 ' O ' ' HB2' ' A' ' 604' ' ' ARG . 87.7 tttt -61.14 -50.39 73.37 Favored 'General case' 0 N--CA 1.422 -1.867 0 O-C-N 124.527 1.142 . . . . 0.0 108.603 178.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 3.5 t-20 -65.68 -40.96 92.91 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.6 ' HG3' ' HA ' ' A' ' 574' ' ' LEU . 4.4 tmtt? -67.03 -56.54 9.64 Favored 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 123.917 0.887 . . . . 0.0 108.812 -177.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -79.11 -2.92 42.94 Favored 'General case' 0 C--N 1.309 -1.172 0 CA-C-N 115.941 -0.572 . . . . 0.0 112.032 -176.001 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . 0.676 ' HB2' ' O ' ' A' ' 600' ' ' LYS . 32.9 ttt180 -68.75 -12.12 61.09 Favored 'General case' 0 N--CA 1.488 1.453 0 C-N-CA 123.526 0.73 . . . . 0.0 110.295 178.151 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 16.0 tpt . . . . . 0 C--N 1.306 -1.294 0 N-CA-C 108.539 -0.911 . . . . 0.0 108.539 179.061 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 18.6 p90 . . . . . 0 N--CA 1.412 -2.336 0 CA-C-O 122.027 0.918 . . . . 0.0 110.565 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -135.76 79.57 1.78 Allowed 'General case' 0 C--N 1.278 -2.5 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 174.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 17.5 m120 -127.97 56.71 1.58 Allowed 'General case' 0 C--N 1.295 -1.787 0 CA-C-N 114.827 -1.079 . . . . 0.0 110.579 -177.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 84.0 mt -72.44 91.06 1.34 Allowed 'General case' 0 N--CA 1.426 -1.649 0 N-CA-C 106.673 -1.602 . . . . 0.0 106.673 170.369 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 12.9 m -60.75 176.65 0.37 Allowed 'General case' 0 C--N 1.297 -1.702 0 N-CA-C 115.123 1.527 . . . . 0.0 115.123 -170.403 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . . . . . . . . . 52.9 ttp180 -54.73 -17.63 3.69 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 126.684 1.993 . . . . 0.0 113.214 -175.655 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -53.07 -44.84 67.8 Favored 'General case' 0 C--O 1.214 -0.796 0 O-C-N 123.188 0.305 . . . . 0.0 110.986 177.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . 0.505 ' O ' ' HG3' ' A' ' 474' ' ' ARG . 38.1 tt0 -66.31 -30.76 71.24 Favored 'General case' 0 C--O 1.217 -0.654 0 C-N-CA 119.511 -0.876 . . . . 0.0 111.046 -178.523 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . 0.462 ' HD3' HH21 ' A' ' 474' ' ' ARG . 27.8 tptp -64.62 -33.01 74.93 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 119.817 -0.753 . . . . 0.0 109.591 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . . . . . . . . . . . -67.8 -44.86 76.37 Favored 'General case' 0 N--CA 1.44 -0.966 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 176.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . 0.434 ' HB3' ' CE2' ' A' ' 504' ' ' PHE . 1.4 mp0 -56.64 -46.16 81.16 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.074 0.464 . . . . 0.0 110.529 172.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.505 ' HG3' ' O ' ' A' ' 470' ' ' GLU . 37.7 mtm-85 -62.81 -37.7 87.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.212 -0.449 . . . . 0.0 111.384 -179.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . 0.654 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -72.13 -39.2 69.0 Favored 'General case' 0 C--N 1.311 -1.068 0 CA-C-O 120.87 0.367 . . . . 0.0 110.927 176.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -63.56 -39.51 94.59 Favored 'General case' 0 C--N 1.31 -1.135 0 CA-C-O 121.682 0.753 . . . . 0.0 110.797 -179.061 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . . . . . . . . . 25.2 tp -71.78 -17.44 62.18 Favored 'General case' 0 CA--C 1.553 1.093 0 CA-C-N 114.788 -1.096 . . . . 0.0 113.67 -173.904 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.654 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 19.5 pttp -70.78 -11.11 60.75 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 112.674 0.62 . . . . 0.0 112.674 -177.009 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 59.2 t-80 -122.93 90.79 3.36 Favored 'General case' 0 C--N 1.312 -1.063 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 178.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.629 ' HA ' ' HB2' ' A' ' 483' ' ' ASP . 4.2 tt -143.02 71.22 1.33 Allowed 'General case' 0 N--CA 1.43 -1.427 0 CA-C-O 121.781 0.8 . . . . 0.0 109.266 177.666 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . . . . . . . . . 65.0 mtt -97.15 -88.73 0.29 Allowed 'General case' 0 C--O 1.199 -1.564 0 CA-C-N 115.211 -0.904 . . . . 0.0 109.561 177.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -72.31 -9.06 58.0 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 125.276 1.431 . . . . 0.0 109.616 174.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . 0.629 ' HB2' ' HA ' ' A' ' 480' ' ' LEU . 5.5 m-20 -69.18 37.48 0.03 OUTLIER 'General case' 0 C--N 1.299 -1.62 0 C-N-CA 128.411 2.685 . . . . 0.0 116.136 -166.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 61.7 pttt -53.41 -40.13 64.86 Favored 'General case' 0 N--CA 1.483 1.208 0 CA-C-O 121.704 0.764 . . . . 0.0 109.983 172.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -60.0 -49.77 76.38 Favored 'General case' 0 CA--C 1.512 -0.481 0 CA-C-N 114.9 -1.045 . . . . 0.0 109.681 177.623 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . 0.578 ' HB ' ' HB3' ' A' ' 483' ' ' ASP . 7.1 m -59.95 -42.18 93.47 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.101 0.96 . . . . 0.0 110.773 -178.866 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -54.79 -51.32 66.12 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 109.535 -0.543 . . . . 0.0 109.535 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 81.1 mt -68.68 -29.7 68.2 Favored 'General case' 0 C--N 1.308 -1.213 0 CA-C-N 116.487 -0.324 . . . . 0.0 111.4 -179.902 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 95.1 m-20 -68.97 -34.26 75.02 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-O 120.778 0.323 . . . . 0.0 111.134 179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -85.27 -40.14 16.93 Favored 'General case' 0 N--CA 1.419 -2.014 0 N-CA-C 109.395 -0.594 . . . . 0.0 109.395 -179.64 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 21.7 t80 -67.8 -35.15 78.13 Favored 'General case' 0 CA--C 1.541 0.601 0 N-CA-C 112.712 0.634 . . . . 0.0 112.712 -179.237 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -77.48 -21.9 52.13 Favored 'General case' 0 C--N 1.31 -1.113 0 CA-C-O 120.871 0.367 . . . . 0.0 110.525 -178.048 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 64.5 m -83.8 -8.6 59.19 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-O 121.32 0.581 . . . . 0.0 111.76 -175.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . 0.427 HG22 ' OD1' ' A' ' 498' ' ' ASN . 0.3 OUTLIER -92.97 153.44 3.32 Favored 'Isoleucine or valine' 0 N--CA 1.426 -1.638 0 N-CA-C 107.537 -1.283 . . . . 0.0 107.537 -176.642 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 31.1 t70 -155.26 -105.69 0.03 OUTLIER 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -172.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . 0.431 ' C ' ' H ' ' A' ' 498' ' ' ASN . 38.8 ttpt -90.3 -37.88 13.76 Favored 'General case' 0 C--N 1.321 -0.651 0 CA-C-O 121.453 0.644 . . . . 0.0 110.533 178.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . . . . . . . . . 20.0 t0 -75.28 30.84 0.1 Allowed 'General case' 0 C--O 1.215 -0.736 0 C-N-CA 126.04 1.736 . . . . 0.0 112.322 -174.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . 0.431 ' H ' ' C ' ' A' ' 496' ' ' LYS . 6.0 m-20 -73.14 36.11 0.08 Allowed 'General case' 0 C--N 1.303 -1.446 0 C-N-CA 126.779 2.032 . . . . 0.0 111.355 -179.979 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.3 p90 -65.79 -13.06 58.72 Favored 'General case' 0 CA--C 1.55 0.965 0 CA-C-N 116.187 -0.46 . . . . 0.0 111.258 -178.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 15.9 m -55.15 149.84 11.73 Favored 'General case' 0 CA--C 1.566 1.574 0 C-N-CA 124.418 1.087 . . . . 0.0 108.743 173.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . . . . . . . . . 49.8 m-80 -65.58 155.23 36.42 Favored 'General case' 0 C--O 1.246 0.918 0 O-C-N 121.615 -0.678 . . . . 0.0 112.032 -174.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 13.3 pt20 -66.64 5.92 0.54 Allowed 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.135 0.493 . . . . 0.0 111.894 179.274 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . 0.483 ' O ' HG23 ' A' ' 507' ' ' VAL . 1.5 m-70 -54.51 -51.78 64.04 Favored 'General case' 0 C--O 1.203 -1.353 0 N-CA-C 107.043 -1.466 . . . . 0.0 107.043 172.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . 0.434 ' CE2' ' HB3' ' A' ' 473' ' ' GLU . 94.2 m-85 -65.15 -27.3 68.63 Favored 'General case' 0 C--N 1.31 -1.139 0 CA-C-N 114.967 -1.015 . . . . 0.0 113.182 -179.847 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 24.1 tptm -68.14 -44.23 76.5 Favored 'General case' 0 N--CA 1.44 -0.967 0 N-CA-C 109.04 -0.726 . . . . 0.0 109.04 179.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -65.81 -38.5 89.13 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 119.787 -0.765 . . . . 0.0 109.677 177.806 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 503' ' ' HIS . 22.1 t -62.18 -47.11 94.66 Favored 'Isoleucine or valine' 0 C--N 1.354 0.778 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -179.782 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 17.5 t80 -47.78 -45.72 29.67 Favored 'General case' 0 N--CA 1.469 0.515 0 C-N-CA 123.697 0.799 . . . . 0.0 111.235 173.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -60.05 -53.19 60.71 Favored 'General case' 0 N--CA 1.444 -0.755 0 CA-C-N 115.636 -0.711 . . . . 0.0 110.445 -179.253 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 18.5 t -58.87 -48.1 87.38 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.887 0 O-C-N 123.406 0.442 . . . . 0.0 109.945 178.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 507' ' ' VAL . 97.1 mt -54.46 -56.53 17.78 Favored 'General case' 0 C--O 1.211 -0.971 0 O-C-N 124.067 0.854 . . . . 0.0 110.545 -178.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -60.3 -30.96 69.83 Favored 'General case' 0 C--N 1.32 -0.712 0 C-N-CA 123.996 0.918 . . . . 0.0 110.774 -177.548 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -69.49 -46.66 66.09 Favored 'General case' 0 C--N 1.315 -0.919 0 CA-C-N 115.96 -0.564 . . . . 0.0 111.597 -178.194 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . 0.251 11.2 p90 -82.83 -28.61 30.05 Favored 'General case' 0 N--CA 1.435 -1.202 0 C-N-CA 119.399 -0.92 . . . . 0.0 111.049 178.374 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 18.6 t80 -51.71 -35.67 43.9 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.802 1.241 . . . . 0.0 108.779 174.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -59.47 -28.83 67.35 Favored 'General case' 0 N--CA 1.452 -0.372 0 CA-C-N 115.036 -0.983 . . . . 0.0 111.234 178.856 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -103.36 -59.57 1.69 Allowed 'General case' 0 N--CA 1.437 -1.099 0 C-N-CA 119.727 -0.789 . . . . 0.0 110.485 179.222 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 52.1 m-80 -157.38 122.18 4.43 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 178.279 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -90.87 96.95 10.89 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 113.918 1.081 . . . . 0.0 113.918 -174.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . . . . . . . . . 85.8 mt-30 -142.27 124.23 15.29 Favored 'General case' 0 C--N 1.301 -1.528 0 N-CA-C 107.275 -1.38 . . . . 0.0 107.275 161.583 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 55.7 t80 -67.97 129.24 39.31 Favored 'General case' 0 N--CA 1.431 -1.413 0 CA-C-N 119.45 1.023 . . . . 0.0 110.497 179.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . . . . . . . . . 25.4 p-10 -113.35 132.24 55.66 Favored 'General case' 0 C--N 1.289 -2.033 0 CA-C-N 114.858 -1.065 . . . . 0.0 109.405 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 35.4 pt -78.47 -13.03 13.71 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.186 0 CA-C-O 121.17 0.51 . . . . 0.0 110.484 -177.75 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . 0.555 ' O ' ' HG2' ' A' ' 528' ' ' GLN . 33.1 t -58.17 -41.01 82.92 Favored 'General case' 0 N--CA 1.436 -1.156 0 CA-C-N 115.39 -0.823 . . . . 0.0 109.373 174.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -65.55 -35.86 82.08 Favored 'General case' 0 C--N 1.348 0.533 0 N-CA-C 108.901 -0.778 . . . . 0.0 108.901 -178.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . . . . . . . . . . . -60.71 -50.32 73.94 Favored 'General case' 0 C--O 1.213 -0.833 0 CA-C-N 115.171 -0.922 . . . . 0.0 111.311 178.704 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . . . . . . . . . 11.9 p -71.17 -18.02 20.27 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.403 0 O-C-N 121.868 -0.52 . . . . 0.0 111.006 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . 0.555 ' HG2' ' O ' ' A' ' 524' ' ' SER . 15.4 mm100 -68.04 -39.78 83.0 Favored 'General case' 0 CA--C 1.517 -0.314 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 170.947 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.52 ' CB ' ' HG3' ' A' ' 536' ' ' ARG . 8.1 m-85 -72.36 13.9 0.29 Allowed 'General case' 0 N--CA 1.465 0.303 0 C-N-CA 125.146 1.378 . . . . 0.0 112.894 176.596 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.758 ' HA ' ' NH2' ' A' ' 536' ' ' ARG . 8.7 p -72.74 18.4 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.592 2.585 0 N-CA-C 114.273 1.212 . . . . 0.0 114.273 -178.453 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 53.1 t-20 -129.16 -49.27 1.2 Allowed 'General case' 0 N--CA 1.479 0.991 0 O-C-N 120.953 -1.092 . . . . 0.0 109.714 176.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . . . . . . . . . 27.4 t -76.04 -144.42 0.02 OUTLIER 'General case' 0 CA--C 1.578 2.036 0 C-N-CA 126.806 2.042 . . . . 0.0 112.349 -176.02 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . 0.481 ' C ' ' H ' ' A' ' 535' ' ' LEU . 2.0 t-20 -28.45 30.42 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.978 1 C-N-CA 138.831 6.853 . . . . 0.0 117.419 179.072 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -32.32 9.92 0.0 OUTLIER 'General case' 0 N--CA 1.523 3.221 1 C-N-CA 131.762 4.025 . . . . 0.0 116.891 179.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.481 ' H ' ' C ' ' A' ' 533' ' ' ASN . 40.9 mt -63.51 -29.36 70.64 Favored 'General case' 0 C--N 1.299 -1.619 0 N-CA-C 102.474 -3.158 . . . . 0.0 102.474 162.051 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.758 ' NH2' ' HA ' ' A' ' 530' ' ' VAL . 0.4 OUTLIER -54.27 -36.92 64.13 Favored 'General case' 0 N--CA 1.429 -1.506 0 CA-C-N 111.897 -2.411 . . . . 0.0 110.279 170.617 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -72.22 -37.24 69.24 Favored 'General case' 0 CA--C 1.483 -1.611 0 N-CA-C 108.046 -1.094 . . . . 0.0 108.046 -175.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . . . . . . . . . 5.9 m -59.64 -40.98 89.44 Favored 'General case' 0 CA--C 1.571 1.77 0 C-N-CA 118.837 -1.145 . . . . 0.0 108.965 170.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 63.8 tp -59.99 -34.51 73.42 Favored 'General case' 0 C--O 1.215 -0.734 0 O-C-N 121.619 -0.676 . . . . 0.0 111.676 174.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . . . . . . . . . 53.0 mt -61.97 -35.12 66.49 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.732 0 N-CA-C 109.911 -0.403 . . . . 0.0 109.911 176.261 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . . . . . . . . . 5.5 p -58.3 -43.96 88.34 Favored 'General case' 0 CA--C 1.549 0.92 0 N-CA-C 108.505 -0.924 . . . . 0.0 108.505 175.165 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . . . . . . . . . 8.2 mp -64.78 -41.15 96.07 Favored 'General case' 0 N--CA 1.487 1.42 0 CA-C-N 115.311 -0.859 . . . . 0.0 111.175 176.653 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 2.8 tm-20 -61.97 -35.42 78.43 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.173 0.989 . . . . 0.0 108.85 179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . 0.494 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 53.4 tt0 -74.05 39.97 0.12 Allowed 'General case' 0 CA--C 1.567 1.606 0 CA-C-O 122.656 1.217 . . . . 0.0 111.209 177.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . . . . . . . . . 35.4 p90 -75.05 157.08 35.41 Favored 'General case' 0 C--N 1.279 -2.47 0 O-C-N 120.949 -1.095 . . . . 0.0 111.086 177.122 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 8.4 p30 -102.73 -178.01 3.55 Favored 'General case' 0 C--N 1.293 -1.886 0 CA-C-N 116.551 -0.295 . . . . 0.0 110.717 -178.71 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.606 ' O ' ' HG3' ' A' ' 550' ' ' GLU . 92.2 mt -76.27 18.96 0.26 Allowed 'General case' 0 C--O 1.208 -1.111 0 N-CA-C 113.293 0.849 . . . . 0.0 113.293 -173.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . 0.487 ' O ' ' HD2' ' A' ' 552' ' ' TYR . 31.3 p-10 -75.02 -8.5 56.71 Favored 'General case' 0 C--N 1.317 -0.836 0 O-C-N 121.934 -0.479 . . . . 0.0 110.974 179.587 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -70.15 0.86 5.45 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.927 0.891 . . . . 0.0 112.35 -178.022 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.606 ' HG3' ' O ' ' A' ' 547' ' ' LEU . 45.8 mt-10 -55.08 133.35 68.29 Favored Pre-proline 0 C--O 1.239 0.544 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 176.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_exo 5.16 61.01 0.0 OUTLIER 'Trans proline' 0 C--N 1.376 1.994 1 C-N-CA 126.843 5.029 . . . . 0.0 115.878 -166.496 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . 0.62 ' O ' ' HG3' ' A' ' 555' ' ' GLU . 1.6 t80 -99.83 21.17 12.94 Favored 'General case' 0 C--O 1.205 -1.248 0 N-CA-C 107.206 -1.405 . . . . 0.0 107.206 -175.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -68.35 11.1 0.18 Allowed 'General case' 0 C--N 1.308 -1.226 0 N-CA-C 114.642 1.349 . . . . 0.0 114.642 -174.806 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . 0.55 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 6.9 t30 -75.18 -20.6 59.23 Favored 'General case' 0 C--O 1.17 -3.098 0 N-CA-C 107.387 -1.338 . . . . 0.0 107.387 171.184 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . 0.62 ' HG3' ' O ' ' A' ' 552' ' ' TYR . 51.3 mt-10 -35.49 -46.04 0.37 Allowed 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 114.517 1.302 . . . . 0.0 114.517 -176.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . . . . . . . . . 59.5 mt -58.78 -38.48 72.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.426 0 CA-C-N 118.28 0.491 . . . . 0.0 110.714 178.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . 0.55 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 3.4 t70 -59.54 -54.59 44.76 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.984 0.914 . . . . 0.0 108.808 176.781 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . 0.605 ' O ' HG23 ' A' ' 562' ' ' VAL . 12.8 m-20 -58.52 -53.92 52.83 Favored 'General case' 0 C--O 1.205 -1.281 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.006 177.71 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . 0.536 ' O ' HD13 ' A' ' 563' ' ' ILE . 63.3 t80 -51.86 -53.28 42.27 Favored 'General case' 0 C--N 1.308 -1.235 0 C-N-CA 126.815 2.046 . . . . 0.0 111.881 -178.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . . . . . . . . . 49.3 t -59.84 -41.39 85.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.564 0 N-CA-C 109.935 -0.395 . . . . 0.0 109.935 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . 0.624 ' O ' ' HG3' ' A' ' 565' ' ' GLU . 8.0 t30 -60.89 -59.73 4.92 Favored 'General case' 0 C--O 1.193 -1.906 0 CA-C-N 115.465 -0.788 . . . . 0.0 110.558 175.227 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . 0.605 HG23 ' O ' ' A' ' 558' ' ' ASP . 60.1 t -55.07 -36.98 40.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.071 0 C-N-CA 124.074 0.949 . . . . 0.0 112.714 -172.753 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.536 HD13 ' O ' ' A' ' 559' ' ' TYR . 1.6 mp -80.15 -40.61 20.35 Favored 'Isoleucine or valine' 0 C--N 1.277 -2.544 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.917 -172.419 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . 0.491 ' HB3' HD21 ' A' ' 574' ' ' LEU . 18.9 t-20 -95.45 7.09 47.25 Favored 'General case' 0 N--CA 1.416 -2.167 0 CA-C-N 115.111 -0.95 . . . . 0.0 109.869 -176.099 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.624 ' HG3' ' O ' ' A' ' 561' ' ' ASN . 52.5 mt-10 -71.67 -23.68 61.71 Favored 'General case' 0 C--N 1.368 1.391 0 N-CA-C 107.263 -1.384 . . . . 0.0 107.263 170.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 62.5 tttm -70.45 56.61 0.17 Allowed 'General case' 0 CA--C 1.557 1.224 0 CA-C-N 113.902 -1.499 . . . . 0.0 114.324 -176.453 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -131.04 -114.66 1.66 Allowed Glycine 0 N--CA 1.435 -1.375 0 N-CA-C 108.113 -1.995 . . . . 0.0 108.113 173.61 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . 0.4 ' C ' ' H ' ' A' ' 570' ' ' THR . 57.4 tp60 -153.8 -78.94 0.1 Allowed 'General case' 0 C--N 1.307 -1.242 0 N-CA-C 108.188 -1.042 . . . . 0.0 108.188 173.066 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -87.06 32.33 0.69 Allowed 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 107.614 -1.254 . . . . 0.0 107.614 177.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . 0.435 ' O ' ' HG ' ' A' ' 574' ' ' LEU . 9.7 m -107.07 -14.76 14.85 Favored 'General case' 0 C--N 1.289 -2.057 0 CA-C-N 114.263 -1.335 . . . . 0.0 111.014 -167.215 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . 0.5 ' O ' ' HB2' ' A' ' 574' ' ' LEU . 6.3 mt -79.83 -37.26 17.92 Favored 'Isoleucine or valine' 0 CA--C 1.48 -1.748 0 CA-C-O 121.861 0.839 . . . . 0.0 110.355 -168.741 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . 0.469 ' OE1' ' HD2' ' A' ' 604' ' ' ARG . 41.7 mt-10 -83.02 -25.07 32.52 Favored 'General case' 0 N--CA 1.405 -2.711 0 CA-C-N 115.083 -0.962 . . . . 0.0 111.944 -179.95 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 19.3 m -65.36 -28.97 69.66 Favored 'General case' 0 C--N 1.316 -0.852 0 N-CA-C 108.302 -0.999 . . . . 0.0 108.302 174.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.5 ' HB2' ' O ' ' A' ' 571' ' ' ILE . 82.1 mt -57.69 -37.5 73.57 Favored 'General case' 0 C--O 1.196 -1.724 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.217 174.584 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . 0.461 ' HB3' HG22 ' A' ' 598' ' ' VAL . 88.3 m-20 -57.14 -48.87 77.62 Favored 'General case' 0 C--O 1.244 0.787 0 O-C-N 123.675 0.609 . . . . 0.0 110.319 -178.667 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 11.4 t60 -64.53 -47.17 79.8 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.135 -0.938 . . . . 0.0 109.551 -179.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . . . . . . . . . 55.3 mtmt -66.47 -40.51 89.39 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -177.775 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -58.57 -49.13 78.58 Favored 'General case' 0 CA--C 1.501 -0.913 0 C-N-CA 120.644 -0.422 . . . . 0.0 110.704 179.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . 0.436 ' HA ' ' HD2' ' A' ' 591' ' ' LYS . 0.0 OUTLIER -58.89 -42.61 89.96 Favored 'General case' 0 CA--C 1.538 0.507 0 O-C-N 124.203 0.939 . . . . 0.0 110.051 179.733 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -69.96 -41.92 73.85 Favored 'General case' 0 C--N 1.313 -0.984 0 CA-C-N 116.277 -0.42 . . . . 0.0 112.032 -176.192 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . . . . . . . . . . . -60.2 -50.5 73.42 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 121.521 0.676 . . . . 0.0 111.522 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . 0.533 ' HB ' ' HB3' ' A' ' 586' ' ' ASP . 22.6 p -72.89 -24.83 60.89 Favored 'General case' 0 C--N 1.299 -1.591 0 N-CA-C 113.609 0.966 . . . . 0.0 113.609 -176.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . . . . . . . . . 53.7 ttt180 -44.01 -9.16 0.01 OUTLIER 'General case' 0 CA--C 1.577 1.993 0 C-N-CA 126.496 1.919 . . . . 0.0 115.269 -178.979 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . . . . . . . . . 37.8 pt -77.03 10.3 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.308 0 C-N-CA 123.833 0.853 . . . . 0.0 112.724 179.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 126.82 14.2 2.86 Favored Glycine 0 N--CA 1.469 0.878 0 C-N-CA 120.35 -0.928 . . . . 0.0 113.673 176.711 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . 0.533 ' HB3' ' HB ' ' A' ' 582' ' ' THR . 34.8 t70 -82.59 167.93 17.82 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 124.259 1.024 . . . . 0.0 111.971 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . . . . . . . . . 8.6 p -41.91 21.85 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.594 2.652 1 C-N-CA 131.933 4.093 . . . . 0.0 115.74 177.575 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.473 ' H ' ' C ' ' A' ' 586' ' ' ASP . 43.0 mm-40 -43.52 -8.34 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.518 0 C-N-CA 129.06 2.944 . . . . 0.0 116.398 -175.123 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . 0.425 ' O ' ' HB3' ' A' ' 592' ' ' TYR . 60.2 mt -69.67 -56.55 6.94 Favored 'General case' 0 C--N 1.287 -2.118 0 N-CA-C 107.43 -1.322 . . . . 0.0 107.43 167.157 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 55.5 tp60 -53.73 -42.44 68.12 Favored 'General case' 0 CA--C 1.513 -0.462 0 CA-C-N 114.226 -1.352 . . . . 0.0 108.433 172.281 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.473 ' HG3' HD22 ' A' ' 594' ' ' LEU . 2.2 ttmp? -80.78 -15.75 55.61 Favored 'General case' 0 C--O 1.197 -1.665 0 CA-C-N 115.422 -0.808 . . . . 0.0 112.606 -178.536 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.425 ' HB3' ' O ' ' A' ' 589' ' ' LEU . 72.7 t80 -59.82 -39.87 86.54 Favored 'General case' 0 CA--C 1.506 -0.745 0 N-CA-C 107.733 -1.21 . . . . 0.0 107.733 173.299 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . . . . . . . . . 14.8 m-85 -56.16 -46.81 79.17 Favored 'General case' 0 CA--C 1.562 1.419 0 CA-C-N 115.246 -0.888 . . . . 0.0 109.696 174.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.473 HD22 ' HG3' ' A' ' 591' ' ' LYS . 9.2 mp -63.75 -33.45 75.69 Favored 'General case' 0 C--O 1.212 -0.879 0 CA-C-O 121.227 0.537 . . . . 0.0 111.107 174.623 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . 0.494 ' HA ' HG23 ' A' ' 598' ' ' VAL . 29.4 tt0 -65.96 -27.53 68.23 Favored 'General case' 0 C--N 1.303 -1.426 0 C-N-CA 123.289 0.636 . . . . 0.0 110.557 179.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 53.7 tt0 -68.21 -41.58 81.1 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 107.815 -1.179 . . . . 0.0 107.815 171.626 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . . . . . . . . . 54.4 mt -59.33 -34.2 53.38 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.738 0 CA-C-N 115.735 -0.666 . . . . 0.0 109.921 173.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . 0.494 HG23 ' HA ' ' A' ' 595' ' ' GLN . 57.8 t -62.24 -36.74 76.11 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.94 0 N-CA-C 109.445 -0.576 . . . . 0.0 109.445 174.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.509 ' O ' ' HB3' ' A' ' 602' ' ' LYS . . . -63.44 -33.5 75.69 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 116.317 -0.401 . . . . 0.0 110.263 177.248 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 13.7 tmtt? -67.18 -38.71 85.84 Favored 'General case' 0 C--O 1.251 1.134 0 CA-C-O 121.633 0.73 . . . . 0.0 109.093 174.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . 0.411 HD22 ' HB3' ' A' ' 572' ' ' GLU . 15.3 t-20 -62.12 -33.38 74.35 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-N 115.672 -0.694 . . . . 0.0 110.593 174.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . 0.509 ' HB3' ' O ' ' A' ' 599' ' ' ALA . 19.4 ttpt -65.13 -46.33 81.41 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.803 -0.635 . . . . 0.0 109.553 173.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . 0.485 ' HG3' ' HE3' ' A' ' 602' ' ' LYS . 44.9 mt-10 -74.07 -1.92 22.17 Favored 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 113.329 0.863 . . . . 0.0 113.329 -176.37 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . 0.469 ' HD2' ' OE1' ' A' ' 572' ' ' GLU . 47.5 mtp180 -67.82 19.93 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.324 0 C-N-CA 123.653 0.781 . . . . 0.0 112.156 171.003 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . 0.457 ' H ' ' C ' ' A' ' 603' ' ' GLU . 56.1 ttp . . . . . 0 C--N 1.296 -1.754 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 -179.483 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 463' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 . . . . . 0 N--CA 1.434 -1.245 0 CA-C-O 120.877 0.37 . . . . 0.0 110.155 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 464' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -130.65 79.55 1.9 Allowed 'General case' 0 C--N 1.298 -1.673 0 N-CA-C 107.939 -1.134 . . . . 0.0 107.939 177.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 465' ' ' ASN . . . . . . . . . . . . . 80.7 m-20 -124.65 46.04 2.4 Favored 'General case' 0 C--N 1.307 -1.245 0 CA-C-N 114.721 -1.127 . . . . 0.0 108.403 -177.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 466' ' ' LEU . . . . . . . . . . . . . 92.2 mt -73.07 103.32 3.79 Favored 'General case' 0 N--CA 1.432 -1.332 0 CA-C-N 115.398 -0.819 . . . . 0.0 110.916 179.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 467' ' ' SER . . . . . . . . . . . . . 39.7 m -101.76 127.86 48.35 Favored 'General case' 0 C--N 1.278 -2.502 0 N-CA-C 108.463 -0.94 . . . . 0.0 108.463 178.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 468' ' ' ARG . . . . . 0.524 ' HB2' HG13 ' A' ' 562' ' ' VAL . 88.4 mtm180 -62.74 -12.77 26.11 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 112.725 0.639 . . . . 0.0 112.725 -177.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 469' ' ' GLN . . . . . 0.461 ' O ' ' HG3' ' A' ' 473' ' ' GLU . 24.6 mt-30 -40.99 -49.55 3.29 Favored 'General case' 0 C--O 1.206 -1.185 0 C-N-CA 125.479 1.511 . . . . 0.0 114.156 -177.789 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 470' ' ' GLU . . . . . . . . . . . . . 3.0 tm-20 -68.74 -31.81 71.14 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-O 120.953 0.406 . . . . 0.0 111.039 -174.803 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 471' ' ' LYS . . . . . . . . . . . . . 22.8 tptp -74.76 -29.81 61.26 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 109.305 -0.628 . . . . 0.0 109.305 177.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 472' ' ' ALA . . . . . 0.537 ' HB2' HG11 ' A' ' 562' ' ' VAL . . . -69.82 -47.92 60.97 Favored 'General case' 0 C--N 1.318 -0.777 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 174.417 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . 0.483 ' O ' ' HG ' ' A' ' 477' ' ' LEU . 57.7 mt-10 -49.81 -49.57 48.32 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.64 0.776 . . . . 0.0 109.488 173.687 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 474' ' ' ARG . . . . . 0.55 ' HG3' ' CD2' ' A' ' 542' ' ' LEU . 11.1 tpp85 -46.79 -60.89 2.12 Favored 'General case' 0 N--CA 1.463 0.181 0 C-N-CA 125.261 1.424 . . . . 0.0 109.657 -178.277 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 475' ' ' ALA . . . . . 0.533 ' O ' ' HG2' ' A' ' 478' ' ' LYS . . . -68.53 -36.01 78.26 Favored 'General case' 0 C--O 1.212 -0.913 0 CA-C-N 115.289 -0.868 . . . . 0.0 112.445 -177.132 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 476' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -33.54 74.69 Favored 'General case' 0 C--N 1.309 -1.162 0 CA-C-O 121.332 0.586 . . . . 0.0 112.079 -177.218 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 477' ' ' LEU . . . . . 0.483 ' HG ' ' O ' ' A' ' 473' ' ' GLU . 94.0 mt -73.47 -8.84 57.57 Favored 'General case' 0 C--N 1.315 -0.926 0 N-CA-C 114.282 1.216 . . . . 0.0 114.282 -176.775 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 478' ' ' LYS . . . . . 0.533 ' HG2' ' O ' ' A' ' 475' ' ' ALA . 63.3 pttt -76.5 6.38 5.86 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.917 -0.49 . . . . 0.0 110.993 -178.133 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 10.4 t-80 -77.75 23.94 0.23 Allowed 'General case' 0 CA--C 1.563 1.448 0 C-N-CA 123.741 0.816 . . . . 0.0 112.729 -172.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 480' ' ' LEU . . . . . 0.4 HD12 ' H ' ' A' ' 482' ' ' ARG 0.29 2.7 pp 49.76 -158.8 0.07 Allowed 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 125.629 1.572 . . . . 0.0 114.798 177.165 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 481' ' ' MET . . . . . 0.469 ' C ' ' H ' ' A' ' 483' ' ' ASP . 46.9 ttm -66.7 6.95 0.41 Allowed 'General case' 0 CA--C 1.569 1.695 0 CA-C-O 122.569 1.175 . . . . 0.0 113.648 -174.659 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 482' ' ' ARG . . . . . 0.4 ' H ' HD12 ' A' ' 480' ' ' LEU . 26.7 mmt180 -74.69 11.1 1.12 Allowed 'General case' 0 C--O 1.248 0.998 0 C-N-CA 123.899 0.88 . . . . 0.0 110.153 167.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 483' ' ' ASP . . . . . 0.469 ' H ' ' C ' ' A' ' 481' ' ' MET . 9.5 p-10 -68.81 1.0 3.65 Favored 'General case' 0 C--O 1.201 -1.478 0 C-N-CA 126.231 1.812 . . . . 0.0 113.608 -169.304 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 484' ' ' LYS . . . . . . . . . . . . . 54.7 mtmt -72.28 -60.37 2.26 Favored 'General case' 0 C--N 1.308 -1.239 0 N-CA-C 108.792 -0.818 . . . . 0.0 108.792 174.422 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 485' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -56.54 -53.52 56.59 Favored 'General case' 0 CA--C 1.491 -1.296 0 CA-C-N 114.869 -1.06 . . . . 0.0 109.544 179.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 486' ' ' THR . . . . . . . . . . . . . 86.1 m -59.44 -37.97 79.49 Favored 'General case' 0 N--CA 1.439 -1.014 0 CA-C-N 114.909 -1.042 . . . . 0.0 111.786 -178.716 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 487' ' ' PHE . . . . . 0.415 ' HB2' ' O ' ' A' ' 483' ' ' ASP . 46.7 t80 -56.15 -58.02 9.73 Favored 'General case' 0 C--O 1.205 -1.269 0 C-N-CA 120.419 -0.513 . . . . 0.0 110.158 179.224 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 488' ' ' LEU . . . . . . . . . . . . . 5.9 mp -72.29 -31.91 66.13 Favored 'General case' 0 C--N 1.314 -0.961 0 C-N-CA 119.454 -0.898 . . . . 0.0 111.364 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 489' ' ' ASN . . . . . . . . . . . . . 27.9 t-20 -68.26 -41.06 81.67 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-O 120.932 0.396 . . . . 0.0 111.32 -177.196 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 490' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -85.28 -35.41 21.53 Favored 'General case' 0 N--CA 1.423 -1.796 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.546 -178.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 491' ' ' TYR . . . . . . . . . . . . . 23.3 t80 -58.26 -46.36 86.15 Favored 'General case' 0 C--O 1.233 0.189 0 C-N-CA 122.873 0.469 . . . . 0.0 112.259 -179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 492' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -81.65 -15.58 54.12 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 113.833 1.049 . . . . 0.0 113.833 -177.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 493' ' ' SER . . . . . . . . . . . . . 73.4 m -80.98 -28.42 35.56 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 112.297 0.48 . . . . 0.0 112.297 -178.293 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 494' ' ' VAL . . . . . . . . . . . . . 11.8 t -98.52 152.3 4.33 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.971 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -176.729 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 495' ' ' ASP . . . . . . . . . . . . . 19.6 t70 -152.23 -39.58 0.11 Allowed 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.693 0.759 . . . . 0.0 110.27 -178.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 496' ' ' LYS . . . . . . . . . . . . . 1.6 mptm? -82.44 18.7 1.4 Allowed 'General case' 0 C--N 1.314 -0.975 0 CA-C-N 115.52 -0.763 . . . . 0.0 111.938 178.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 497' ' ' ASP . . . . . 0.742 ' O ' ' HB3' ' A' ' 501' ' ' ASN . 7.6 p-10 -65.93 -19.51 65.89 Favored 'General case' 0 C--O 1.21 -1.023 0 C-N-CA 123.837 0.855 . . . . 0.0 110.78 -178.99 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . 0.437 ' HA ' ' ND2' ' A' ' 501' ' ' ASN . 6.9 t-20 -72.88 15.45 0.2 Allowed 'General case' 0 CA--C 1.548 0.897 0 C-N-CA 124.751 1.22 . . . . 0.0 114.023 -165.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 499' ' ' PHE . . . . . . . . . . . . . 8.2 p90 -75.65 -71.95 0.34 Allowed 'General case' 0 C--N 1.314 -0.966 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 176.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 500' ' ' THR . . . . . . . . . . . . . 26.0 m -127.36 93.36 3.71 Favored 'General case' 0 C--N 1.303 -1.452 0 N-CA-C 105.648 -1.982 . . . . 0.0 105.648 170.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 501' ' ' ASN . . . . . 0.742 ' HB3' ' O ' ' A' ' 497' ' ' ASP . 34.8 p-10 -127.14 46.33 2.54 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 113.849 1.055 . . . . 0.0 113.849 -169.127 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 502' ' ' GLN . . . . . . . . . . . . . 18.3 pm0 -73.17 -25.29 60.74 Favored 'General case' 0 C--N 1.302 -1.49 0 C-N-CA 119.319 -0.952 . . . . 0.0 108.485 173.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 503' ' ' HIS . . . . . 0.436 ' O ' HG23 ' A' ' 507' ' ' VAL . 38.3 t-80 -62.64 -64.49 0.9 Allowed 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.218 175.888 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 504' ' ' PHE . . . . . . . . . . . . . 47.4 t80 -55.74 -38.48 69.85 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 124.025 0.93 . . . . 0.0 110.639 -179.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 505' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -64.88 -52.02 58.82 Favored 'General case' 0 CA--C 1.5 -0.943 0 C-N-CA 123.079 0.552 . . . . 0.0 109.595 -179.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 506' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 -62.61 -41.67 99.13 Favored 'General case' 0 N--CA 1.428 -1.571 0 N-CA-C 113.337 0.865 . . . . 0.0 113.337 179.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 507' ' ' VAL . . . . . 0.436 HG23 ' O ' ' A' ' 503' ' ' HIS . 67.0 t -62.36 -52.96 53.63 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.698 0 C-N-CA 120.436 -0.506 . . . . 0.0 109.714 178.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 508' ' ' PHE . . . . . . . . . . . . . 56.9 t80 -49.64 -53.06 26.41 Favored 'General case' 0 N--CA 1.449 -0.49 0 O-C-N 124.534 1.146 . . . . 0.0 111.838 176.031 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 509' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -56.79 -62.63 1.6 Allowed 'General case' 0 C--N 1.322 -0.625 0 C-N-CA 123.321 0.648 . . . . 0.0 112.185 -177.312 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 510' ' ' VAL . . . . . . . . . . . . . 48.6 t -59.69 -45.85 93.98 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.665 0 O-C-N 123.692 0.62 . . . . 0.0 110.944 -176.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 511' ' ' LEU . . . . . . . . . . . . . 3.2 tt -69.23 -49.08 59.66 Favored 'General case' 0 N--CA 1.435 -1.221 0 CA-C-N 115.7 -0.682 . . . . 0.0 109.955 -172.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 512' ' ' HIS . . . . . . . . . . . . . 7.6 t-80 -67.76 -29.52 68.75 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 116.623 -0.262 . . . . 0.0 111.185 -176.228 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 513' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -64.43 -49.23 72.33 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-O 121.244 0.545 . . . . 0.0 110.434 178.707 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 514' ' ' PHE . . . . . . . . . . . . . 59.7 m-85 -70.48 -55.25 9.4 Favored 'General case' 0 C--O 1.198 -1.627 0 CA-C-N 115.246 -0.888 . . . . 0.0 111.232 179.36 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 515' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -52.67 -36.32 56.74 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 112.877 0.695 . . . . 0.0 112.877 -178.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 516' ' ' ALA . . . . . . . . . . . . . . . -77.6 -19.38 55.67 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 113.477 0.917 . . . . 0.0 113.477 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 517' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -115.34 -45.6 2.92 Favored 'General case' 0 C--N 1.312 -1.05 0 CA-C-O 122.111 0.958 . . . . 0.0 110.018 -172.792 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 518' ' ' ASN . . . . . . . . . . . . . 39.0 t-20 -112.38 -154.34 0.54 Allowed 'General case' 0 C--N 1.286 -2.169 0 N-CA-C 106.617 -1.623 . . . . 0.0 106.617 -173.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 519' ' ' ASP . . . . . 0.406 ' HB3' ' H ' ' A' ' 520' ' ' GLN . 9.1 m-20 -83.82 -160.24 0.43 Allowed 'General case' 0 C--N 1.308 -1.221 0 C-N-CA 123.468 0.707 . . . . 0.0 109.878 177.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 520' ' ' GLN . . . . . 0.555 ' NE2' ' H ' ' A' ' 520' ' ' GLN . 0.0 OUTLIER -62.62 177.12 0.56 Allowed 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.617 0.767 . . . . 0.0 110.257 178.265 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 521' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -88.11 148.81 24.27 Favored 'General case' 1 N--CA 1.37 -4.449 0 O-C-N 121.543 -0.723 . . . . 0.0 109.638 -175.242 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 522' ' ' ASN . . . . . 0.493 ' HB3' ' OD2' ' A' ' 525' ' ' ASP . 52.0 t30 -116.11 154.64 29.6 Favored 'General case' 0 C--N 1.316 -0.887 0 CA-C-O 121.466 0.65 . . . . 0.0 111.313 -174.634 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 523' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -66.93 -37.21 78.96 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.936 0 C-N-CA 124.776 1.23 . . . . 0.0 110.7 -178.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 524' ' ' SER . . . . . . . . . . . . . 39.0 t -57.1 -33.01 66.88 Favored 'General case' 0 C--N 1.31 -1.146 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.956 179.384 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 525' ' ' ASP . . . . . 0.493 ' OD2' ' HB3' ' A' ' 522' ' ' ASN . 12.0 m-20 -61.1 -40.69 94.7 Favored 'General case' 0 CA--C 1.509 -0.631 0 CA-C-O 121.303 0.573 . . . . 0.0 110.0 177.988 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 526' ' ' ALA . . . . . 0.47 ' HA ' ' HD3' ' A' ' 536' ' ' ARG . . . -63.57 -43.17 97.79 Favored 'General case' 0 C--N 1.323 -0.575 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.243 178.019 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 527' ' ' VAL . . . . . 0.495 ' O ' HG22 ' A' ' 530' ' ' VAL . 96.9 t -64.63 -35.34 74.49 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.498 0 C-N-CA 125.033 1.333 . . . . 0.0 110.805 -178.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 528' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -66.74 -34.63 78.26 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.43 0.634 . . . . 0.0 109.595 175.4 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.605 ' HB3' ' HD2' ' A' ' 536' ' ' ARG . 1.1 t80 -77.28 2.62 15.11 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 113.723 1.008 . . . . 0.0 113.723 -178.735 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 530' ' ' VAL . . . . . 0.495 HG22 ' O ' ' A' ' 527' ' ' VAL . 14.7 m -74.69 15.0 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.241 0 N-CA-C 115.979 1.844 . . . . 0.0 115.979 -176.174 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 531' ' ' ASN . . . . . . . . . . . . . 46.7 m-80 -109.03 -36.22 6.13 Favored 'General case' 0 C--N 1.285 -2.228 0 C-N-CA 119.458 -0.897 . . . . 0.0 108.644 179.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 532' ' ' SER . . . . . 0.495 ' C ' ' H ' ' A' ' 534' ' ' GLU . 26.3 t -81.44 -143.16 0.05 OUTLIER 'General case' 0 C--N 1.29 -2.019 0 C-N-CA 125.63 1.572 . . . . 0.0 107.673 173.234 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 533' ' ' ASN . . . . . 0.463 ' C ' ' H ' ' A' ' 535' ' ' LEU 0.386 17.2 m120 -35.14 29.08 0.0 OUTLIER 'General case' 0 N--CA 1.499 1.986 1 C-N-CA 132.926 4.49 . . . . 0.0 118.764 171.607 . . . . . . . . 4 3 . 1 . 020 nuclear nobuild full ' A' A ' 534' ' ' GLU . . . . . 0.495 ' H ' ' C ' ' A' ' 532' ' ' SER . 9.6 pt-20 -34.63 8.04 0.0 OUTLIER 'General case' 0 N--CA 1.503 2.194 0 C-N-CA 130.515 3.526 . . . . 0.0 116.008 177.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 535' ' ' LEU . . . . . 0.463 ' H ' ' C ' ' A' ' 533' ' ' ASN . 3.3 pp -67.77 -21.36 65.26 Favored 'General case' 0 C--N 1.291 -1.957 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 162.179 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 536' ' ' ARG . . . . . 0.605 ' HD2' ' HB3' ' A' ' 529' ' ' TYR . 28.0 ttm-85 -66.56 -24.86 66.42 Favored 'General case' 0 N--CA 1.429 -1.501 0 CA-C-N 113.676 -1.602 . . . . 0.0 110.445 171.191 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . 0.45 ' HA ' HD12 ' A' ' 540' ' ' ILE . 2.4 tm-20 -75.34 -39.2 59.63 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 106.618 -1.623 . . . . 0.0 106.618 177.803 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 538' ' ' THR . . . . . 0.414 ' O ' ' HB2' ' A' ' 541' ' ' SER . 8.9 m -57.7 -42.23 83.29 Favored 'General case' 0 CA--C 1.563 1.48 0 CA-C-N 115.453 -0.794 . . . . 0.0 109.45 173.61 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 539' ' ' LEU . . . . . . . . . . . . . 52.3 tp -59.07 -43.09 91.71 Favored 'General case' 0 CA--C 1.55 0.963 0 CA-C-N 116.278 -0.419 . . . . 0.0 110.031 175.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 540' ' ' ILE . . . . . 0.566 ' O ' ' HG2' ' A' ' 544' ' ' GLN . 75.2 mt -57.29 -40.51 74.35 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.256 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 175.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 541' ' ' SER . . . . . 0.414 ' HB2' ' O ' ' A' ' 538' ' ' THR . 26.4 m -56.31 -38.79 71.75 Favored 'General case' 0 CA--C 1.556 1.191 0 CA-C-O 120.934 0.397 . . . . 0.0 111.339 177.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 542' ' ' LEU . . . . . 0.615 ' O ' ' HB3' ' A' ' 545' ' ' TYR . 8.3 mp -69.59 -24.8 63.73 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-O 120.801 0.334 . . . . 0.0 111.644 174.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 543' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -75.44 -38.64 59.6 Favored 'General case' 0 CA--C 1.554 1.13 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.621 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 544' ' ' GLN . . . . . 0.566 ' HG2' ' O ' ' A' ' 540' ' ' ILE . 74.7 mm-40 -79.5 33.63 0.25 Allowed 'General case' 0 N--CA 1.504 2.26 0 C-N-CA 125.763 1.625 . . . . 0.0 110.481 177.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 545' ' ' TYR . . . . . 0.615 ' HB3' ' O ' ' A' ' 542' ' ' LEU . 8.6 p90 -65.12 154.49 37.76 Favored 'General case' 0 N--CA 1.404 -2.77 0 N-CA-C 114.637 1.347 . . . . 0.0 114.637 -169.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 546' ' ' ASN . . . . . . . . . . . . . 15.4 t-20 -83.6 -176.19 6.18 Favored 'General case' 0 C--N 1.313 -0.999 0 CA-C-N 114.497 -1.228 . . . . 0.0 109.017 -174.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 547' ' ' LEU . . . . . 0.421 ' C ' ' H ' ' A' ' 549' ' ' ASP . 2.2 pp -69.45 17.54 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 114.677 1.362 . . . . 0.0 114.677 -174.927 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 548' ' ' ASN . . . . . . . . . . . . . 15.8 m120 -73.96 22.43 0.09 Allowed 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 126.251 1.821 . . . . 0.0 111.782 177.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 549' ' ' ASP . . . . . 0.421 ' H ' ' C ' ' A' ' 547' ' ' LEU . 28.5 t70 -72.12 -6.79 45.05 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 124.008 0.923 . . . . 0.0 112.19 -177.588 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 550' ' ' GLU . . . . . 0.409 ' HB2' ' HD2' ' A' ' 551' ' ' PRO . 1.0 OUTLIER -59.43 158.91 18.6 Favored Pre-proline 0 CA--C 1.548 0.896 0 CA-C-O 119.313 -0.375 . . . . 0.0 110.266 -177.629 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 551' ' ' PRO . . . . . 0.409 ' HD2' ' HB2' ' A' ' 550' ' ' GLU . 20.0 Cg_endo -59.7 72.99 0.06 OUTLIER 'Trans proline' 0 CA--C 1.549 1.247 0 C-N-CA 122.86 2.373 . . . . 0.0 115.105 -179.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 552' ' ' TYR . . . . . . . . . . . . . 77.1 t80 -100.67 9.7 42.11 Favored 'General case' 0 C--N 1.308 -1.199 0 N-CA-C 106.224 -1.769 . . . . 0.0 106.224 173.658 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 553' ' ' GLU . . . . . . . . . . . . . 44.4 mt-10 -69.35 14.2 0.1 Allowed 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 113.408 -1.724 . . . . 0.0 113.934 -174.47 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 554' ' ' ASN . . . . . 0.546 ' O ' ' HB3' ' A' ' 557' ' ' ASP . 3.9 t30 -68.5 -19.98 64.56 Favored 'General case' 0 C--O 1.192 -1.953 0 N-CA-C 104.12 -2.548 . . . . 0.0 104.12 165.729 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 555' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -33.46 -42.06 0.09 Allowed 'General case' 0 C--O 1.191 -1.989 0 C-N-CA 127.528 2.331 . . . . 0.0 111.783 168.587 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 556' ' ' ILE . . . . . 0.425 HG22 ' HD3' ' A' ' 577' ' ' LYS . 21.9 mm -62.02 -44.3 98.77 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 N-CA-C 109.425 -0.584 . . . . 0.0 109.425 177.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 557' ' ' ASP . . . . . 0.546 ' HB3' ' O ' ' A' ' 554' ' ' ASN . 6.4 t70 -58.64 -44.11 89.96 Favored 'General case' 0 C--O 1.25 1.112 0 C-N-CA 124.261 1.024 . . . . 0.0 110.443 176.625 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 558' ' ' ASP . . . . . . . . . . . . . 28.7 t70 -68.91 -49.21 60.08 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 115.458 -0.792 . . . . 0.0 110.325 177.309 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 559' ' ' TYR . . . . . 0.471 ' CD1' ' HB1' ' A' ' 472' ' ' ALA . 48.4 t80 -50.25 -52.06 39.38 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 125.164 1.386 . . . . 0.0 111.356 178.527 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 560' ' ' VAL . . . . . 0.418 HG21 ' CD ' ' A' ' 577' ' ' LYS . 48.4 t -62.96 -39.18 84.17 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 116.155 -0.475 . . . . 0.0 111.213 -179.326 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 561' ' ' ASN . . . . . . . . . . . . . 8.8 t30 -61.45 -36.5 80.58 Favored 'General case' 0 C--O 1.207 -1.164 0 CA-C-O 120.705 0.288 . . . . 0.0 110.514 175.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 562' ' ' VAL . . . . . 0.537 HG11 ' HB2' ' A' ' 472' ' ' ALA . 54.0 t -70.63 -33.75 54.3 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.05 0 C-N-CA 123.863 0.865 . . . . 0.0 112.905 177.692 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 563' ' ' ILE . . . . . 0.444 HG12 ' O ' ' A' ' 559' ' ' TYR . 49.1 mm -84.17 -40.1 15.25 Favored 'Isoleucine or valine' 0 C--N 1.274 -2.717 0 N-CA-C 107.892 -1.151 . . . . 0.0 107.892 -176.965 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 564' ' ' ASN . . . . . . . . . . . . . 10.9 t30 -79.39 -2.97 44.17 Favored 'General case' 0 N--CA 1.436 -1.155 0 CA-C-N 114.449 -1.25 . . . . 0.0 110.164 178.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 565' ' ' GLU . . . . . 0.522 ' HB3' ' O ' ' A' ' 562' ' ' VAL . 19.1 tt0 -56.55 -35.08 67.73 Favored 'General case' 0 CA--C 1.51 -0.562 0 N-CA-C 106.828 -1.545 . . . . 0.0 106.828 170.201 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 566' ' ' LYS . . . . . . . . . . . . . 19.9 mmtp -117.44 20.36 13.61 Favored 'General case' 0 N--CA 1.439 -1.013 0 CA-C-N 113.927 -1.488 . . . . 0.0 109.885 179.065 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 567' ' ' GLY . . . . . . . . . . . . . . . -102.75 -121.17 4.87 Favored Glycine 0 N--CA 1.432 -1.61 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.674 -176.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 568' ' ' GLN . . . . . . . . . . . . . 94.3 mt-30 -145.8 -92.01 0.09 Allowed 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 112.421 0.526 . . . . 0.0 112.421 -176.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 569' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -65.14 117.33 7.58 Favored 'General case' 0 CA--C 1.502 -0.877 0 C-N-CA 123.425 0.69 . . . . 0.0 110.968 -173.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 570' ' ' THR . . . . . 0.626 ' O ' ' HG ' ' A' ' 574' ' ' LEU . 88.1 m -104.56 -77.41 0.58 Allowed 'General case' 0 N--CA 1.423 -1.803 0 N-CA-C 115.102 1.519 . . . . 0.0 115.102 -171.873 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 571' ' ' ILE . . . . . . . . . . . . . 7.3 tt -53.14 -51.36 39.89 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 N-CA-C 115.014 1.487 . . . . 0.0 115.014 -163.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 572' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -79.44 -26.62 41.76 Favored 'General case' 0 C--N 1.307 -1.242 0 C-N-CA 119.727 -0.789 . . . . 0.0 111.583 -175.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 573' ' ' SER . . . . . . . . . . . . . 20.9 m -65.82 -35.66 81.31 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 176.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 574' ' ' LEU . . . . . 0.626 ' HG ' ' O ' ' A' ' 570' ' ' THR . 60.9 mt -61.18 -51.9 67.09 Favored 'General case' 0 C--O 1.208 -1.118 0 CA-C-N 115.488 -0.778 . . . . 0.0 109.124 175.087 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 575' ' ' ASN . . . . . . . . . . . . . 21.6 m120 -58.36 -41.21 84.21 Favored 'General case' 0 C--O 1.241 0.608 0 CA-C-O 120.931 0.396 . . . . 0.0 111.985 -179.158 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 576' ' ' HIS . . . . . . . . . . . . . 11.5 t-160 -61.15 -47.74 84.85 Favored 'General case' 0 C--O 1.249 1.067 0 CA-C-O 121.631 0.729 . . . . 0.0 109.995 175.968 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 577' ' ' LYS . . . . . 0.584 ' HA ' ' HE3' ' A' ' 577' ' ' LYS . 0.7 OUTLIER -67.54 -42.71 82.28 Favored 'General case' 0 C--N 1.31 -1.132 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.066 -177.749 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 578' ' ' LEU . . . . . 0.432 ' HG ' HD21 ' A' ' 594' ' ' LEU . 54.4 tp -55.41 -48.12 74.87 Favored 'General case' 0 C--N 1.32 -0.679 0 C-N-CA 123.943 0.897 . . . . 0.0 111.797 -179.364 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 579' ' ' ARG . . . . . . . . . . . . . 7.7 ptp180 -62.66 -39.64 94.55 Favored 'General case' 0 C--O 1.251 1.177 0 C-N-CA 120.249 -0.58 . . . . 0.0 110.926 178.437 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 580' ' ' GLU . . . . . 0.691 ' O ' ' HB3' ' A' ' 583' ' ' ARG . 31.9 tt0 -68.63 -33.59 74.28 Favored 'General case' 0 C--O 1.215 -0.716 0 CA-C-O 121.007 0.432 . . . . 0.0 109.951 177.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 581' ' ' ALA . . . . . 0.489 ' O ' HG12 ' A' ' 584' ' ' ILE . . . -61.29 -48.91 79.22 Favored 'General case' 0 C--O 1.183 -2.433 0 C-N-CA 122.568 0.347 . . . . 0.0 110.319 174.573 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 582' ' ' THR . . . . . . . . . . . . . 32.7 p -60.63 -24.89 65.88 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 113.527 0.936 . . . . 0.0 113.527 179.68 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 583' ' ' ARG . . . . . 0.691 ' HB3' ' O ' ' A' ' 580' ' ' GLU . 60.0 ttt180 -53.87 -6.39 0.09 Allowed 'General case' 0 CA--C 1.601 2.927 0 C-N-CA 123.896 0.878 . . . . 0.0 112.275 169.361 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 584' ' ' ILE . . . . . 0.489 HG12 ' O ' ' A' ' 581' ' ' ALA . 31.8 pt -72.05 41.23 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.507 2.401 0 C-N-CA 124.524 1.13 . . . . 0.0 113.399 177.615 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 585' ' ' GLY . . . . . . . . . . . . . . . 131.04 -55.45 0.77 Allowed Glycine 0 C--N 1.281 -2.501 0 CA-C-O 119.035 -0.87 . . . . 0.0 114.831 169.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 586' ' ' ASP . . . . . . . . . . . . . 36.6 m-20 -87.67 75.44 9.01 Favored 'General case' 0 C--N 1.302 -1.472 0 CA-C-N 119.42 1.61 . . . . 0.0 109.204 176.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 587' ' ' VAL . . . . . 0.549 ' O ' ' HB3' ' A' ' 591' ' ' LYS . 59.6 t -64.69 -67.16 0.41 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.164 0 CA-C-N 115.14 -0.936 . . . . 0.0 110.532 -177.771 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 588' ' ' GLU . . . . . 0.499 ' O ' ' HB2' ' A' ' 592' ' ' TYR . 0.0 OUTLIER -61.55 -47.55 85.03 Favored 'General case' 0 C--N 1.307 -1.24 0 N-CA-C 111.929 0.344 . . . . 0.0 111.929 -177.368 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 589' ' ' LEU . . . . . . . . . . . . . 9.9 tt -70.39 -66.13 0.64 Allowed 'General case' 0 C--N 1.319 -0.735 0 N-CA-C 112.713 0.635 . . . . 0.0 112.713 -174.689 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 590' ' ' GLN . . . . . . . . . . . . . 56.5 tp60 -60.91 -42.48 98.15 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -175.139 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 591' ' ' LYS . . . . . 0.549 ' HB3' ' O ' ' A' ' 587' ' ' VAL . 58.7 tttm -65.7 -37.13 85.59 Favored 'General case' 0 C--O 1.223 -0.336 0 CA-C-O 119.62 -0.229 . . . . 0.0 110.864 -179.33 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 592' ' ' TYR . . . . . 0.499 ' HB2' ' O ' ' A' ' 588' ' ' GLU . 58.1 t80 -57.02 -51.67 68.33 Favored 'General case' 0 N--CA 1.469 0.514 0 N-CA-C 109.01 -0.737 . . . . 0.0 109.01 178.464 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 593' ' ' TYR . . . . . 0.492 ' O ' HG13 ' A' ' 597' ' ' ILE . 56.2 m-85 -62.74 -59.97 4.15 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.563 178.459 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 594' ' ' LEU . . . . . 0.432 HD21 ' HG ' ' A' ' 578' ' ' LEU . 40.8 tp -55.69 -53.23 59.18 Favored 'General case' 0 CA--C 1.497 -1.093 0 O-C-N 123.703 0.627 . . . . 0.0 112.104 -172.568 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 595' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -65.07 -36.69 85.12 Favored 'General case' 0 N--CA 1.426 -1.634 0 CA-C-N 115.725 -0.67 . . . . 0.0 111.081 -175.386 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 596' ' ' GLN . . . . . . . . . . . . . 48.8 tt0 -63.29 -46.43 86.81 Favored 'General case' 0 C--O 1.242 0.706 0 N-CA-C 109.683 -0.488 . . . . 0.0 109.683 176.404 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 597' ' ' ILE . . . . . 0.492 HG13 ' O ' ' A' ' 593' ' ' TYR . 80.4 mt -57.66 -57.99 8.03 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.587 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.477 176.071 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 598' ' ' VAL . . . . . . . . . . . . . 94.7 t -62.0 -41.72 92.11 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.514 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.637 -175.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 599' ' ' ALA . . . . . 0.433 ' O ' ' HG2' ' A' ' 603' ' ' GLU . . . -59.74 -46.11 90.15 Favored 'General case' 0 C--O 1.24 0.578 0 CA-C-O 120.886 0.374 . . . . 0.0 110.004 178.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 600' ' ' LYS . . . . . . . . . . . . . 39.1 ttpt -64.45 -46.34 83.57 Favored 'General case' 0 C--O 1.211 -0.963 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.563 178.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 601' ' ' ASN . . . . . . . . . . . . . 26.6 t-20 -62.54 -34.68 77.4 Favored 'General case' 0 C--N 1.316 -0.857 0 C-N-CA 123.82 0.848 . . . . 0.0 111.727 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 602' ' ' LYS . . . . . . . . . . . . . 31.1 ttmt -65.71 -54.9 21.07 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.399 -179.166 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 603' ' ' GLU . . . . . 0.433 ' HG2' ' O ' ' A' ' 599' ' ' ALA . 12.0 pt-20 -75.61 -17.06 60.14 Favored 'General case' 0 C--N 1.318 -0.78 0 CA-C-N 115.451 -0.795 . . . . 0.0 111.84 -177.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 604' ' ' ARG . . . . . . . . . . . . . 27.7 ttp180 -69.4 -40.53 77.28 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 177.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 605' ' ' MET . . . . . . . . . . . . . 28.4 ttt . . . . . 0 N--CA 1.469 0.504 0 C-N-CA 124.749 1.22 . . . . 0.0 109.779 -176.582 . . . . . . . . 0 0 . 1 stop_ save_