data_6t3i_residue ############################ # Computer software used # ############################ 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 6t3i _Structure_validation_residue.Date_analyzed 2020-11-20 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 ' 470' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--O 1.226 -0.177 0 CA-C-O 121.091 0.472 . . . . 0.0 111.615 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 53.7 t -56.18 -47.78 80.24 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.907 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.751 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -63.44 -34.18 77.18 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -67.16 -42.74 83.83 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 177.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 17.5 mttt -69.43 -35.48 75.72 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 121.727 0.775 . . . . 0.0 109.997 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.13 -37.42 71.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.879 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -54.46 -40.68 68.63 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.405 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -72.36 -54.06 10.52 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.131 177.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.47 -46.75 73.43 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 -177.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.4 t-160 -61.33 -41.06 96.39 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 52.5 m -64.06 -40.57 96.56 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.97 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -63.72 -43.09 97.59 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-N 118.153 0.433 . . . . 0.0 110.652 178.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.02 -46.89 66.02 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.19 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 177.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -67.01 -39.5 87.11 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -177.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -68.57 -28.07 66.63 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 122.157 -0.339 . . . . 0.0 110.755 177.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.69 -18.42 62.82 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.6 mt -105.99 12.08 30.89 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.874 -177.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 52.4 mttt -54.09 127.29 26.03 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.6 t -62.26 -42.11 94.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.932 0.872 . . . . 0.0 109.678 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.33 -30.66 69.68 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.205 -1.362 . . . . 0.0 112.943 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 14.2 t -155.31 75.9 5.17 Favored Pre-proline 0 C--O 1.244 0.769 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -175.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -74.95 146.65 33.13 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 117.394 -1.271 . . . . 0.0 112.72 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -137.28 100.76 4.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.331 0.586 . . . . 0.0 109.762 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.72 -46.13 96.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -58.09 -31.12 66.81 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.064 0.227 . . . . 0.0 110.447 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -69.28 -41.11 77.28 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.69 -49.04 69.99 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 83.4 mt -56.85 -44.18 81.91 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.07 -41.07 97.77 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.6 0.714 . . . . 0.0 110.824 179.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.93 -47.3 69.07 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.286 0.565 . . . . 0.0 109.767 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -46.32 79.82 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.186 177.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -64.66 -35.36 80.79 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 119.032 0.833 . . . . 0.0 113.123 -176.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -68.88 -46.61 67.95 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 176.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.69 -33.23 68.15 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.427 0.632 . . . . 0.0 110.547 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.76 -19.21 67.09 Favored Glycine 0 C--O 1.238 0.345 0 CA-C-O 119.312 -0.716 . . . . 0.0 114.543 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.7 t -109.98 -13.75 14.36 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.91 0.855 . . . . 0.0 110.237 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.0 mt -67.3 145.91 54.65 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.964 -0.46 . . . . 0.0 110.344 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -79.37 84.45 5.28 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-O 122.79 1.281 . . . . 0.0 109.809 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.8 m -95.69 46.49 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 CA-C-O 122.9 1.333 . . . . 0.0 108.433 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.4 t -66.67 171.78 4.84 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 -177.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.1 m -49.26 -30.9 7.89 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -174.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -56.09 -46.58 78.99 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 175.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -86.72 -41.77 15.08 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.51 -39.69 77.05 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -68.12 -31.21 70.64 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.392 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -90.38 -4.44 57.06 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 122.172 -0.33 . . . . 0.0 111.331 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -127.94 41.11 3.56 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.276 0.56 . . . . 0.0 111.458 -179.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.2 p -63.64 -27.93 69.56 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 121.604 -0.685 . . . . 0.0 112.776 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.13 -26.41 68.18 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.617 0.722 . . . . 0.0 111.842 177.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 47.6 t -71.93 -43.15 68.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 44.9 t -62.71 -35.23 69.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 178.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.09 85.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 119.228 -0.415 . . . . 0.0 111.368 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.0 m -78.14 -37.91 44.96 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 118.991 0.814 . . . . 0.0 109.719 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 39.5 mt -57.97 -35.0 70.56 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.076 0.465 . . . . 0.0 111.178 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -64.56 -29.08 70.11 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.803 -0.561 . . . . 0.0 111.536 175.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -74.31 -41.62 60.83 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.2 pt -78.74 -23.14 13.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.103 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.4 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.2 OUTLIER -63.15 -13.07 32.64 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 176.26 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.7 ptt180 -119.14 16.35 13.23 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 122.822 0.449 . . . . 0.0 110.841 176.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -64.66 121.82 15.38 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.059 0.457 . . . . 0.0 112.103 -175.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -92.29 -25.62 18.5 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -177.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.02 -25.51 65.43 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.637 -177.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.86 121.22 9.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.915 0.388 . . . . 0.0 110.371 174.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -39.99 94.98 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.91 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -60.68 -40.95 94.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.614 0.721 . . . . 0.0 111.745 -176.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 59.4 t -56.01 -43.39 75.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.957 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.7 ttp -66.27 -40.73 90.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 122.066 0.146 . . . . 0.0 110.621 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.42 -48.41 70.12 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -69.7 -38.26 76.9 Favored 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 118.977 -1.089 . . . . 0.0 110.244 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.63 -39.87 81.75 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -67.2 -48.37 68.09 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -40.79 90.53 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 62.1 t -70.63 -53.1 23.73 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.3 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . 0.515 ' CE1' ' HD3' ' A' ' 547' ' ' LYS . 51.6 t80 -55.0 -41.74 71.65 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.181 0.515 . . . . 0.0 110.901 -177.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 544' ' ' THR . . . . . 0.458 ' HA ' ' HE3' ' A' ' 547' ' ' LYS . 30.0 m -65.27 -38.55 90.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.141 0.496 . . . . 0.0 111.197 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 -64.74 -27.05 68.64 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.177 177.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 11.9 mt -73.94 -37.8 64.45 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -176.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . 0.515 ' HD3' ' CE1' ' A' ' 543' ' ' TYR . 5.2 mtmp? -63.76 -24.73 67.88 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.273 178.114 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 C--N 1.319 -0.722 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.127 178.484 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.221 -0.406 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 48.6 t -53.75 -49.25 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -65.92 -32.28 73.69 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.693 -178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -67.47 -40.71 85.31 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 12.7 mtpt -72.32 -32.99 67.03 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.499 -176.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.7 -40.11 71.93 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.548 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -53.23 -39.85 64.11 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 121.245 -0.182 . . . . 0.0 110.895 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -71.97 -55.24 7.79 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.265 176.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -47.06 78.43 Favored 'General case' 0 C--O 1.218 -0.563 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -175.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -61.47 -39.88 92.49 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 59.1 m -64.92 -41.25 95.72 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.587 179.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -63.19 -43.17 98.94 Favored 'General case' 0 CA--C 1.506 -0.718 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.805 178.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.14 -47.62 66.76 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -67.36 -37.68 83.58 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -176.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -67.73 -31.64 71.71 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.55 -19.09 65.24 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 23.8 mt -103.06 12.19 36.27 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 38.6 mttt -55.57 128.52 34.93 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 72.2 t -61.43 -43.12 96.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.816 0.817 . . . . 0.0 109.66 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -74.23 -19.84 60.38 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.469 -1.242 . . . . 0.0 113.456 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 7.3 m -156.39 69.0 4.79 Favored Pre-proline 0 N--CA 1.47 0.574 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -176.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.58 145.11 29.16 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 114.267 -3.355 . . . . 0.0 112.573 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -137.33 96.76 3.33 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.892 0.853 . . . . 0.0 109.867 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -56.32 -46.43 81.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -178.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.35 -30.67 69.69 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -69.73 -40.43 76.22 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 -178.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.97 -49.1 71.61 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 87.5 mt -56.64 -43.06 79.89 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -64.39 -38.54 91.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.387 0.613 . . . . 0.0 111.425 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.03 -48.53 68.07 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 177.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.38 -43.73 79.5 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.207 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -65.59 -33.78 76.7 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 119.315 0.961 . . . . 0.0 112.912 -177.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.98 -46.58 64.89 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 175.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -34.36 65.98 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.44 0.638 . . . . 0.0 110.983 -179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.92 -18.43 68.65 Favored Glycine 0 C--O 1.237 0.333 0 CA-C-O 119.235 -0.759 . . . . 0.0 114.883 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 15.1 t -110.29 -14.64 14.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 117.992 0.896 . . . . 0.0 110.354 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.5 mt -65.39 144.01 57.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.0 0.428 . . . . 0.0 110.728 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -78.62 84.34 4.73 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 122.46 1.124 . . . . 0.0 109.192 177.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 29.5 m -97.13 46.77 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-O 123.11 1.433 . . . . 0.0 108.922 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.6 t -67.34 172.93 4.34 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.3 m -49.11 -33.68 12.34 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -173.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -55.18 -43.06 73.98 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 178.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.1 mp -88.45 -41.76 14.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -39.16 83.04 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -67.13 -32.46 73.6 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.682 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -88.99 -3.85 58.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.999 -0.28 . . . . 0.0 110.56 178.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -129.01 42.73 3.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.4 p -64.28 -28.16 69.53 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.499 -0.751 . . . . 0.0 112.248 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -67.51 -24.05 65.53 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.506 0.67 . . . . 0.0 111.952 177.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 60.8 t -71.97 -45.13 65.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 178.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 42.7 t -62.24 -35.51 69.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.77 94.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.175 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 98.6 m -74.41 -38.99 62.94 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 119.168 0.895 . . . . 0.0 110.407 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 63.5 mt -57.29 -35.15 69.44 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.998 0.428 . . . . 0.0 111.334 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -65.7 -29.23 69.74 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.769 -0.582 . . . . 0.0 111.762 175.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -73.02 -44.42 60.9 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.974 0.416 . . . . 0.0 110.877 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 17.3 pt -78.54 -21.94 13.16 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.784 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -176.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.404 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.6 OUTLIER -61.45 -18.36 58.58 Favored 'General case' 0 C--O 1.214 -0.803 0 O-C-N 121.741 -0.6 . . . . 0.0 111.968 175.402 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.75 19.42 13.16 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 122.897 0.479 . . . . 0.0 111.379 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -64.64 113.67 3.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.97 0.414 . . . . 0.0 112.01 -177.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -75.22 -30.0 60.44 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -176.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.25 95.77 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -174.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -131.21 110.83 11.42 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.11 -0.329 . . . . 0.0 110.11 -178.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 39.3 tptt -56.27 -43.85 79.19 Favored 'General case' 0 C--O 1.207 -1.139 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.211 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -55.49 -42.67 74.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.123 0.487 . . . . 0.0 112.172 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.1 t -57.09 -44.46 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -63.87 -44.24 93.68 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.59 -47.47 78.54 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 41.5 tptt -70.27 -38.95 75.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 118.488 -1.285 . . . . 0.0 110.715 -178.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.06 -40.94 86.72 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.368 0.604 . . . . 0.0 109.392 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.9 -48.73 77.7 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.081 -0.963 . . . . 0.0 113.503 179.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -41.76 89.68 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.2 t -70.51 -52.81 26.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.876 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.514 -177.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . 0.509 ' CE1' ' HD3' ' A' ' 547' ' ' LYS . 37.5 t80 -54.91 -42.51 72.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.343 0.592 . . . . 0.0 111.253 -177.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.5 m -66.95 -36.9 83.26 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.877 0.37 . . . . 0.0 110.447 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 10.7 mtt85 -63.69 -30.06 71.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.761 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 13.2 mt -71.7 -38.23 70.59 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -175.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . 0.509 ' HD3' ' CE1' ' A' ' 543' ' ' TYR . 4.2 mtmp? -61.08 -29.5 69.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.935 -1.029 . . . . 0.0 112.317 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 C--N 1.32 -0.685 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.582 176.807 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--O 1.224 -0.252 0 CA-C-O 120.709 0.29 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 34.1 t -55.17 -46.85 77.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.019 0 O-C-N 122.114 -0.366 . . . . 0.0 110.719 178.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.4 pt-20 -61.26 -34.15 74.69 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -67.03 -40.93 87.31 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 122.378 1.085 . . . . 0.0 108.678 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -74.08 -34.8 64.13 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.35 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 4.2 tt -58.88 -36.82 75.28 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.244 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -57.58 -41.58 81.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 119.244 0.929 . . . . 0.0 109.908 178.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -68.07 -53.18 27.44 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.618 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -46.34 84.96 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -179.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -58.41 -44.71 89.13 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.0 m -63.17 -38.59 91.77 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.57 -37.57 88.01 Favored 'General case' 0 CA--C 1.498 -1.03 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.75 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.7 mt -58.95 -42.26 85.51 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.053 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 22.4 mmtt -64.9 -45.36 86.27 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 120.864 0.364 . . . . 0.0 111.7 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -66.9 -28.51 68.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.414 -178.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.96 -17.81 63.32 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 122.722 0.409 . . . . 0.0 111.912 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.8 mt -109.63 12.14 24.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.605 -176.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -53.25 128.29 27.54 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.3 t -60.31 -42.36 90.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.825 0.822 . . . . 0.0 109.672 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -71.88 -24.87 61.74 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.378 -1.283 . . . . 0.0 113.168 -177.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 46.5 m -156.34 72.7 5.0 Favored Pre-proline 0 C--O 1.244 0.814 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -176.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.93 144.66 43.55 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 115.95 -2.234 . . . . 0.0 112.484 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -137.23 102.04 4.71 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.114 0.483 . . . . 0.0 109.874 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -61.08 -47.33 94.05 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.882 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -178.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -57.26 -31.16 65.29 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 123.118 0.261 . . . . 0.0 110.497 -178.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -69.38 -40.88 77.14 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.26 -49.56 69.12 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 70.2 mt -56.89 -44.13 82.01 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -176.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -61.45 -39.14 89.75 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.681 0.753 . . . . 0.0 111.749 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -72.18 -46.58 55.77 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.372 0.606 . . . . 0.0 109.831 178.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -48.67 71.92 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.925 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -60.84 -35.99 77.97 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -175.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.13 -47.08 53.73 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.03 -34.48 68.23 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.335 0.588 . . . . 0.0 110.153 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.51 -14.53 64.78 Favored Glycine 0 C--O 1.236 0.224 0 N-CA-C 115.339 0.896 . . . . 0.0 115.339 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 15.1 t -111.97 -16.92 13.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 117.767 0.783 . . . . 0.0 110.493 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.6 mt -63.88 150.8 44.13 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.213 -0.304 . . . . 0.0 110.947 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -79.51 84.53 5.37 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-O 122.6 1.19 . . . . 0.0 109.188 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 30.0 m -101.04 48.21 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.279 0 CA-C-O 123.367 1.556 . . . . 0.0 108.029 -178.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 13.7 t -67.79 171.86 6.03 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.1 m -49.23 -31.0 7.89 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -173.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -55.45 -44.1 76.06 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 122.292 -0.255 . . . . 0.0 111.558 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -88.6 -42.36 14.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.543 0 CA-C-O 121.683 0.754 . . . . 0.0 109.275 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -40.86 82.26 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -174.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -72.48 -28.74 63.09 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.399 -175.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -88.6 -9.16 53.16 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 122.198 -0.314 . . . . 0.0 110.762 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -125.53 39.71 3.9 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.486 0.66 . . . . 0.0 111.402 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -62.78 -23.87 67.44 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.67 -31.46 72.69 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.995 0.902 . . . . 0.0 112.365 178.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 60.2 t -70.26 -41.76 78.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 42.0 t -63.39 -37.71 80.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.2 -34.11 77.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.593 177.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 88.0 m -76.59 -39.39 52.72 Favored 'General case' 0 C--O 1.219 -0.509 0 O-C-N 122.172 -0.33 . . . . 0.0 110.414 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 57.9 mt -59.16 -35.0 72.76 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.215 0.531 . . . . 0.0 110.734 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -63.47 -29.14 70.47 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 122.007 -0.433 . . . . 0.0 111.159 175.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -73.82 -42.72 60.49 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.5 pt -78.77 -23.06 12.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.425 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.37 -13.96 34.9 Favored 'General case' 0 C--O 1.214 -0.791 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 177.039 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -118.59 15.83 13.69 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.094 0.558 . . . . 0.0 111.401 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -69.46 116.93 10.44 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 122.889 0.476 . . . . 0.0 111.409 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -92.35 -16.44 26.0 Favored 'General case' 0 C--O 1.217 -0.605 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -177.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -69.5 -22.23 63.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.472 -178.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -150.38 126.27 10.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.584 0.231 . . . . 0.0 110.654 174.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -63.06 -49.29 75.13 Favored 'General case' 0 C--O 1.21 -0.979 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.049 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -57.14 -39.31 74.94 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.259 0.552 . . . . 0.0 111.94 -174.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.88 -45.35 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 122.057 -0.402 . . . . 0.0 110.024 176.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.2 ttp -67.29 -44.0 80.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 119.407 -0.33 . . . . 0.0 110.2 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -64.04 -47.4 80.35 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -70.3 -37.99 74.88 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 119.245 -0.982 . . . . 0.0 110.954 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.56 -40.93 84.42 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-O 121.83 0.824 . . . . 0.0 108.813 178.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.425 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.78 -51.11 66.31 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.144 -1.389 . . . . 0.0 113.921 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -43.75 84.83 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.93 -52.16 37.24 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.93 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.449 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -54.56 -46.04 73.59 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.583 0.23 . . . . 0.0 110.534 -177.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 41.3 m -64.67 -36.56 84.67 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.639 0.776 . . . . 0.0 111.443 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -63.73 -27.84 69.48 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.649 -0.657 . . . . 0.0 110.704 175.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 11.5 mt -74.47 -36.23 63.29 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . 0.448 ' HA ' ' HZ1' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -60.75 -30.62 70.12 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.459 178.74 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--N 1.318 -0.79 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.888 178.296 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.4 m . . . . . 0 CA--C 1.52 -0.174 0 CA-C-O 121.132 0.491 . . . . 0.0 111.805 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 46.9 t -55.93 -47.01 80.51 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.974 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -66.63 -34.17 77.27 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -66.16 -40.27 90.41 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -71.46 -34.69 70.45 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.64 0.733 . . . . 0.0 110.342 -179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -57.12 -39.78 75.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.437 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -53.63 -38.52 64.15 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.938 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -72.96 -54.22 9.2 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.012 175.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.81 -48.07 76.04 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -61.85 -40.73 96.37 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 66.8 m -63.86 -41.07 97.87 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.612 179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.73 -41.92 95.59 Favored 'General case' 0 CA--C 1.5 -0.961 0 C-N-CA 120.858 -0.337 . . . . 0.0 111.017 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.73 -46.14 73.81 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.273 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -67.78 -39.52 84.08 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -68.48 -30.55 69.42 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 120.717 0.294 . . . . 0.0 110.621 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.17 -18.84 65.45 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.6 mt -105.35 12.09 32.03 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -54.82 130.56 41.43 Favored 'General case' 0 C--O 1.21 -1.006 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.1 t -63.93 -41.19 91.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-O 122.152 0.977 . . . . 0.0 109.063 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -68.64 -28.49 66.94 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.919 -1.492 . . . . 0.0 113.24 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 66.3 m -158.93 76.2 3.28 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.66 146.64 49.38 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 115.702 -2.399 . . . . 0.0 111.794 178.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -137.31 91.32 2.6 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.749 0.785 . . . . 0.0 110.14 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 1.3 p -57.21 -46.97 84.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 -177.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -58.87 -30.97 68.13 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -177.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -70.2 -41.91 73.06 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.02 -49.46 72.3 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 176.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.7 mt -57.3 -42.61 82.11 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -176.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -65.17 -39.18 92.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.369 0.604 . . . . 0.0 111.407 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.62 -47.65 69.03 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.21 -44.78 79.83 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.389 177.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -66.8 -34.31 77.55 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 119.264 0.938 . . . . 0.0 113.493 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -69.1 -45.11 71.05 Favored 'General case' 0 C--O 1.225 -0.216 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 176.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.59 -33.37 66.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.543 0.687 . . . . 0.0 110.069 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.25 -16.17 64.34 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-O 119.181 -0.788 . . . . 0.0 114.656 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.7 t -114.82 -12.44 12.1 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.311 1.056 . . . . 0.0 110.815 179.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.1 mt -67.47 144.92 55.46 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.752 -0.593 . . . . 0.0 111.179 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -76.44 84.35 3.17 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-O 122.684 1.231 . . . . 0.0 109.279 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 29.1 m -97.99 46.91 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 CA-C-O 122.596 1.189 . . . . 0.0 109.127 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.7 t -67.41 172.84 4.5 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 46.1 m -49.32 -33.92 14.42 Favored 'General case' 0 C--O 1.218 -0.596 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -174.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -53.33 -44.86 68.78 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -88.35 -42.6 14.93 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -39.17 78.54 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -175.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -70.26 -29.71 66.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.114 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -90.16 -2.45 58.07 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.345 -0.222 . . . . 0.0 110.95 177.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -129.61 45.48 2.8 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.759 0.79 . . . . 0.0 111.999 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.4 p -64.84 -28.53 69.62 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.731 -0.606 . . . . 0.0 112.515 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -67.04 -26.27 66.68 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.508 0.671 . . . . 0.0 111.885 178.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.84 -43.42 79.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 41.6 t -63.85 -35.43 73.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.63 -38.21 89.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 119.305 -0.378 . . . . 0.0 110.963 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.6 m -75.43 -39.24 59.13 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 118.999 0.818 . . . . 0.0 109.654 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 46.8 mt -57.57 -35.0 69.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.03 0.443 . . . . 0.0 111.394 178.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -64.66 -29.16 70.15 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.878 -0.514 . . . . 0.0 111.561 175.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -73.4 -49.02 29.27 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.622 0.248 . . . . 0.0 110.984 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -73.34 -21.9 19.01 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.963 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 -175.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.429 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -60.45 -18.35 50.72 Favored 'General case' 0 C--O 1.214 -0.785 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 176.639 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -118.81 19.37 13.14 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 122.911 0.484 . . . . 0.0 111.279 176.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -63.19 113.6 3.27 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 121.156 0.503 . . . . 0.0 111.842 -176.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -75.54 -30.97 59.91 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 115.686 1.736 . . . . 0.0 115.686 -176.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.65 -42.43 95.44 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.032 0.444 . . . . 0.0 112.159 -174.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -129.88 109.81 11.2 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.4 tptt -56.06 -42.47 76.7 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.938 178.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -55.7 -43.08 76.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.154 0.502 . . . . 0.0 111.795 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 69.2 t -57.99 -43.74 85.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 177.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -44.63 95.8 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.78 -47.74 77.02 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.605 -0.438 . . . . 0.0 112.013 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -68.59 -39.94 80.72 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.854 -178.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.42 -41.11 88.76 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.429 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.26 -48.33 78.63 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -42.15 95.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.253 0.549 . . . . 0.0 109.681 -179.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 77.3 t -70.57 -51.63 35.68 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.456 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -53.44 -45.26 69.4 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 122.526 0.33 . . . . 0.0 110.841 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 22.6 m -65.03 -36.91 85.9 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 122.925 0.49 . . . . 0.0 111.342 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 42.2 mtt85 -62.0 -28.95 69.93 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 121.672 -0.643 . . . . 0.0 110.661 176.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 5.5 mt -76.51 -31.72 57.84 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 -176.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 -31.64 72.48 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.81 177.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 16.2 m . . . . . 0 C--N 1.319 -0.746 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 177.017 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.7 m . . . . . 0 C--O 1.224 -0.287 0 CA-C-O 120.862 0.363 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.4 t -54.25 -45.91 67.88 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -65.03 -34.07 77.55 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -66.44 -41.36 89.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -73.21 -33.3 65.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.808 -176.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.69 -35.49 74.6 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.631 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -58.12 -40.27 80.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 119.037 0.835 . . . . 0.0 110.053 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -65.32 -55.83 16.09 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -45.8 90.37 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -177.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -58.61 -42.72 88.82 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 53.9 m -64.63 -39.08 93.07 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 121.197 -0.201 . . . . 0.0 111.434 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -63.54 -37.67 88.18 Favored 'General case' 0 CA--C 1.508 -0.653 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.6 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.6 mt -59.17 -43.02 88.55 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -63.45 -44.92 93.11 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.75 -32.4 73.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.79 0.329 . . . . 0.0 110.979 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.58 -17.34 64.6 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.3 mt -109.69 12.06 24.33 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -55.29 132.4 47.81 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 177.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.73 -41.45 92.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 122.316 1.055 . . . . 0.0 108.723 177.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -66.42 -31.22 71.85 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 113.519 -1.673 . . . . 0.0 113.152 -178.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 11.1 t -160.48 76.97 2.65 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -175.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -73.99 144.95 34.94 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 116.68 -1.747 . . . . 0.0 112.716 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -137.34 102.24 4.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.685 0.755 . . . . 0.0 110.88 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.11 -45.39 95.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -59.66 -31.9 69.97 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -70.1 -41.13 74.43 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -177.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -48.75 73.1 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 176.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 87.5 mt -56.94 -44.59 82.66 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -176.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -63.16 -39.04 93.51 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.799 0.809 . . . . 0.0 111.446 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -69.71 -47.27 63.74 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.448 0.642 . . . . 0.0 109.934 178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.59 -48.26 75.13 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.641 178.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.36 -36.6 82.73 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -175.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -70.05 -45.7 66.55 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -35.77 70.42 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.295 0.569 . . . . 0.0 110.054 -179.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.91 -17.65 67.75 Favored Glycine 0 C--O 1.244 0.762 0 N-CA-C 115.288 0.875 . . . . 0.0 115.288 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.9 t -108.56 -13.43 14.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.512 0.656 . . . . 0.0 109.822 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.1 mt -69.99 149.47 47.7 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -79.82 84.39 5.62 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-O 122.56 1.172 . . . . 0.0 109.281 177.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.3 m -98.16 47.93 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 CA-C-O 123.247 1.499 . . . . 0.0 107.608 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.9 t -66.31 173.68 3.09 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 113.807 -1.542 . . . . 0.0 107.167 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.3 m -49.38 -34.67 16.69 Favored 'General case' 0 C--O 1.215 -0.713 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -54.28 -45.15 72.43 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 177.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.4 mp -86.52 -40.0 13.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 CA-C-O 121.691 0.758 . . . . 0.0 109.324 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -38.16 81.13 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -175.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -67.1 -35.0 78.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.348 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -86.83 -6.86 58.67 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.116 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -128.74 45.64 2.75 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.914 0.864 . . . . 0.0 112.924 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.9 p -65.0 -24.23 67.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.357 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.08 -33.84 76.68 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.56 1.172 . . . . 0.0 112.231 178.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 86.1 t -68.43 -43.45 84.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.3 t -63.43 -37.1 78.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.36 -36.68 84.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.582 177.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.6 m -75.58 -39.73 57.64 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 118.215 0.461 . . . . 0.0 109.797 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 55.4 mt -58.19 -34.88 70.84 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.921 0.391 . . . . 0.0 111.257 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -64.22 -29.07 70.19 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.858 -0.526 . . . . 0.0 111.317 175.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -73.76 -46.02 48.27 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.72 0.295 . . . . 0.0 111.401 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -77.49 -20.6 14.07 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.164 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -176.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.465 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.21 -15.6 47.74 Favored 'General case' 0 C--O 1.211 -0.957 0 O-C-N 121.952 -0.467 . . . . 0.0 112.156 176.056 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -119.21 19.33 12.88 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.155 0.582 . . . . 0.0 111.456 176.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -63.75 116.25 5.55 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.276 0.56 . . . . 0.0 112.294 -175.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -83.18 -27.99 29.65 Favored 'General case' 0 C--O 1.216 -0.667 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -177.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.26 -27.38 66.28 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -147.97 114.94 6.12 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 177.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -63.12 -38.27 90.5 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -175.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -58.77 -38.94 79.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.919 0.39 . . . . 0.0 111.481 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.6 t -58.47 -44.64 89.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 177.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 3.3 ttp -64.22 -42.03 96.76 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 110.445 -0.206 . . . . 0.0 110.445 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.3 -49.43 74.04 Favored 'General case' 0 C--N 1.32 -0.713 0 O-C-N 123.191 0.307 . . . . 0.0 111.164 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.6 tptt -71.33 -38.05 71.7 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 118.868 -1.133 . . . . 0.0 111.335 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.7 -40.91 85.02 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.465 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.7 -51.12 66.42 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.748 -1.115 . . . . 0.0 113.904 178.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -44.03 90.16 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 -179.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.7 t -67.4 -51.23 54.56 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.957 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.811 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -54.26 -44.67 72.0 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -178.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 28.1 m -65.28 -39.21 92.26 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.132 0.573 . . . . 0.0 111.3 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 43.1 mtt-85 -57.95 -31.74 67.13 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 121.844 -0.535 . . . . 0.0 110.109 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 4.1 mt -76.62 -31.79 57.63 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -175.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 -38.89 91.25 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.772 177.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 C--N 1.322 -0.628 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 178.169 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 5.5 m . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 120.781 0.324 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -53.35 -45.54 56.68 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.956 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . 0.41 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.2 OUTLIER -63.51 -33.62 75.98 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -178.825 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -70.59 -40.37 73.27 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -74.1 -31.66 62.9 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.708 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.34 -39.24 66.89 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.239 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -53.21 -38.74 63.14 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.4 0.148 . . . . 0.0 111.4 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -67.89 -58.22 4.93 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.332 176.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -46.48 88.87 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -174.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.2 t-160 -59.29 -41.15 88.27 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 59.5 m -65.64 -39.32 91.29 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 118.184 0.447 . . . . 0.0 111.46 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -63.28 -38.03 89.55 Favored 'General case' 0 CA--C 1.506 -0.721 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.92 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.63 -43.13 86.74 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.121 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 179.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 53.9 mmtt -63.18 -45.6 91.04 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.04 -33.1 75.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.885 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.78 -18.48 65.39 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 30.9 mt -108.45 12.02 26.51 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 -177.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 47.3 mttt -55.18 129.18 37.25 Favored 'General case' 0 C--O 1.21 -0.985 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 176.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 53.8 t -62.92 -41.81 94.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-O 122.261 1.029 . . . . 0.0 108.638 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -68.51 -26.77 65.62 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.592 -1.64 . . . . 0.0 113.573 -179.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 26.8 m -158.12 73.04 4.02 Favored Pre-proline 0 N--CA 1.473 0.722 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.21 145.14 34.31 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 115.728 -2.381 . . . . 0.0 112.79 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -137.23 97.78 3.57 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.714 0.769 . . . . 0.0 110.553 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.39 -46.57 85.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -58.42 -32.1 68.35 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -71.19 -40.64 71.09 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 -176.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -64.3 -49.43 71.83 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 175.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.6 mt -56.84 -43.28 80.94 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -176.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -65.54 -38.07 88.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.471 0.653 . . . . 0.0 111.795 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -66.04 -48.52 70.81 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.818 0.818 . . . . 0.0 109.33 177.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -43.43 82.87 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.059 178.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -60.6 -37.47 81.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 119.035 0.834 . . . . 0.0 112.476 -177.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.02 -41.45 59.3 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.518 -0.873 . . . . 0.0 108.84 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.7 -34.01 69.0 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.422 0.629 . . . . 0.0 110.108 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.38 -19.31 66.42 Favored Glycine 0 N--CA 1.452 -0.29 0 N-CA-C 114.915 0.726 . . . . 0.0 114.915 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.7 t -112.41 -13.81 13.35 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.102 0.951 . . . . 0.0 110.925 -178.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.72 144.66 56.76 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -77.84 84.78 4.14 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-O 122.814 1.293 . . . . 0.0 109.561 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.6 m -97.22 48.11 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-O 122.862 1.315 . . . . 0.0 108.281 -178.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.6 t -66.62 172.75 3.9 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 22.5 m -49.22 -33.28 12.21 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -174.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -55.44 -44.32 76.22 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.323 -0.236 . . . . 0.0 111.442 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.4 mp -86.13 -42.06 15.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.41 -37.28 80.35 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -174.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -67.82 -31.75 71.82 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.524 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -89.73 -4.71 57.57 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 121.016 -0.273 . . . . 0.0 110.599 178.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -128.48 46.32 2.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.596 0.712 . . . . 0.0 112.24 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 25.7 p -65.59 -25.6 67.47 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 121.455 -0.778 . . . . 0.0 112.257 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.71 -29.08 68.24 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 122.682 1.229 . . . . 0.0 112.405 178.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 79.5 t -68.62 -44.74 82.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.4 t -63.86 -37.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.93 -35.35 79.82 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.867 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 92.3 m -77.46 -38.85 48.44 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 118.749 0.704 . . . . 0.0 109.41 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 43.8 mt -58.21 -35.21 71.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.06 0.457 . . . . 0.0 111.117 178.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -64.5 -29.11 70.15 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.923 -0.486 . . . . 0.0 111.486 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -74.29 -42.12 60.07 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.006 0.372 . . . . 0.0 112.006 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -78.84 -22.7 12.88 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.002 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 -178.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -16.87 55.99 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 176.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -118.74 19.34 13.19 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 123.323 0.649 . . . . 0.0 111.336 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -67.5 110.75 3.78 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -73.82 -30.34 62.65 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -176.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.1 -41.85 97.12 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -174.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -131.53 109.29 10.16 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -178.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -54.99 -43.34 73.46 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.97 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -55.03 -42.76 73.0 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.995 0.426 . . . . 0.0 111.999 -177.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 74.7 t -58.14 -44.46 87.57 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -62.53 -44.61 95.92 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.07 -47.16 78.25 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.38 -0.528 . . . . 0.0 112.185 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.0 tptt -68.67 -39.43 80.63 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.295 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.5 -40.23 86.39 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 121.59 0.709 . . . . 0.0 109.113 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -64.49 -48.95 73.26 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.703 -1.135 . . . . 0.0 113.113 179.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -42.74 90.74 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.7 t -69.45 -52.01 36.71 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.912 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.276 -178.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -54.0 -46.07 71.65 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 122.291 0.236 . . . . 0.0 110.661 -176.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 17.3 m -65.97 -35.28 80.15 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 122.884 0.474 . . . . 0.0 111.026 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -61.74 -29.69 70.28 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.775 -0.578 . . . . 0.0 110.154 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 8.6 mt -76.52 -32.13 58.09 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 -175.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.05 -28.89 69.92 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.601 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 23.0 m . . . . . 0 C--N 1.315 -0.916 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.336 176.691 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.0 m . . . . . 0 C--O 1.224 -0.242 0 CA-C-O 120.924 0.393 . . . . 0.0 111.5 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 40.1 t -54.16 -47.92 66.53 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 O-C-N 122.027 -0.421 . . . . 0.0 111.702 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -61.69 -34.18 75.3 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -178.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.13 -42.24 80.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 122.237 1.018 . . . . 0.0 108.46 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -71.65 -35.32 70.33 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.469 -177.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 4.6 tt -58.15 -35.38 71.45 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.72 178.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -56.7 -42.15 78.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 118.966 0.803 . . . . 0.0 109.778 177.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -68.37 -53.8 21.51 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.727 178.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -46.15 83.69 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 112.284 0.475 . . . . 0.0 112.284 -178.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.3 t-160 -58.09 -44.72 87.76 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.7 m -63.14 -38.22 90.31 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -64.66 -37.43 87.54 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.43 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.1 mt -58.92 -43.42 88.56 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.7 mmtt -63.66 -42.14 98.12 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -66.95 -34.69 78.32 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 120.788 0.327 . . . . 0.0 110.583 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -16.12 63.94 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 36.4 mt -111.94 12.08 20.72 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -58.56 133.24 55.66 Favored 'General case' 0 CA--C 1.489 -1.379 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 15.7 m -69.23 -16.13 20.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.022 177.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -91.89 -23.53 19.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.949 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 50.6 m -161.15 73.55 2.62 Favored Pre-proline 0 N--CA 1.469 0.494 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -175.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.35 142.55 33.65 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 113.822 -3.652 . . . . 0.0 112.381 178.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -137.36 101.86 4.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.589 0.709 . . . . 0.0 110.532 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -57.54 -45.4 86.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 13.2 pttt -59.53 -32.32 70.2 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-O 121.718 0.77 . . . . 0.0 109.605 -176.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -71.53 -39.63 70.6 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.064 -176.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.71 -49.15 66.97 Favored 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 91.4 mt -56.9 -43.3 81.21 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 111.519 0.192 . . . . 0.0 111.519 -176.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -65.89 -33.23 75.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.418 0.628 . . . . 0.0 112.204 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -72.62 -47.06 50.9 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.53 -45.87 80.9 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.439 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -60.46 -36.32 77.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 119.063 0.847 . . . . 0.0 112.688 -176.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.36 -47.32 43.23 Favored 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.76 -35.01 68.14 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.183 0.516 . . . . 0.0 110.768 -178.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.75 -18.05 69.88 Favored Glycine 0 C--O 1.241 0.592 0 N-CA-C 115.156 0.822 . . . . 0.0 115.156 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.0 t -108.63 -14.16 14.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 117.554 0.677 . . . . 0.0 110.059 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.4 mt -67.82 148.49 51.13 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -79.09 84.25 5.1 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-O 122.734 1.254 . . . . 0.0 108.785 177.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 30.3 m -98.92 49.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.353 0 CA-C-O 123.133 1.444 . . . . 0.0 107.527 -178.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.4 t -67.1 173.15 3.94 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 34.4 m -49.32 -32.37 10.99 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -174.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.53 -44.46 76.72 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 177.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.05 -42.52 15.01 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 CA-C-O 121.62 0.724 . . . . 0.0 109.264 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -40.08 81.76 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -175.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -70.21 -31.05 68.32 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.191 -177.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -88.65 -7.85 55.64 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.397 178.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -126.29 40.85 3.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.564 0.697 . . . . 0.0 111.745 -178.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 11.6 p -62.66 -24.02 67.41 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 -179.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.4 -31.09 72.15 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.557 0.694 . . . . 0.0 112.102 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 24.3 t -70.92 -41.99 77.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 38.3 t -62.91 -38.46 81.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.48 -32.59 74.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.613 177.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.4 m -79.68 -39.38 31.46 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 37.1 mt -58.27 -35.65 72.1 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.199 0.523 . . . . 0.0 111.069 179.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -63.52 -29.09 70.41 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 122.117 -0.365 . . . . 0.0 111.412 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -74.07 -44.3 54.61 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 122.318 -0.239 . . . . 0.0 111.637 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -78.81 -19.96 13.02 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -176.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.429 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.86 -13.44 44.95 Favored 'General case' 0 C--O 1.212 -0.896 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 176.542 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -120.88 19.38 11.74 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 122.999 0.52 . . . . 0.0 111.505 176.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -64.98 118.82 9.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.111 0.482 . . . . 0.0 112.183 -177.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -83.79 -29.7 27.18 Favored 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -177.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.12 99.39 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.32 0.581 . . . . 0.0 111.488 -174.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.9 m120 -132.9 111.61 11.2 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -60.32 -36.53 78.13 Favored 'General case' 0 C--O 1.21 -0.993 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.793 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -57.1 -42.3 80.52 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.241 0.543 . . . . 0.0 112.138 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.4 t -58.5 -43.08 86.13 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 5.3 ttp -64.8 -40.82 95.86 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -63.87 -51.55 64.06 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -70.34 -38.79 74.91 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 119.289 -0.964 . . . . 0.0 111.751 -177.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.79 -39.4 80.96 Favored 'General case' 0 C--O 1.212 -0.878 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.429 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.71 -48.77 70.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.518 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -42.25 91.87 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.1 t -70.4 -50.29 47.08 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.452 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -55.93 -44.97 78.84 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.643 0.258 . . . . 0.0 110.36 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 19.1 m -67.63 -33.64 75.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.339 0.59 . . . . 0.0 110.954 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 10.9 mtt85 -61.44 -28.52 69.33 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 121.78 -0.575 . . . . 0.0 109.932 175.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 11.0 mt -76.68 -35.22 58.06 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 -175.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . 0.511 ' HA ' ' HZ1' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -63.94 -27.74 69.35 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.395 177.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 C--N 1.316 -0.885 0 CA-C-N 114.693 -1.14 . . . . 0.0 111.739 177.886 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.7 m . . . . . 0 C--O 1.223 -0.311 0 CA-C-O 120.924 0.392 . . . . 0.0 111.335 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 25.7 t -53.18 -48.63 54.12 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . 0.45 ' CD ' ' HZ3' ' A' ' 515' ' ' LYS . 0.3 OUTLIER -63.88 -34.09 77.16 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.698 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -66.17 -39.57 89.85 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -74.33 -35.87 63.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.03 -178.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 5.3 tt -59.03 -35.51 73.43 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.531 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -56.38 -41.03 75.57 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -69.64 -53.22 19.76 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.43 -46.35 83.65 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -59.39 -41.82 90.26 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.6 m -64.66 -41.16 96.28 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.289 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -62.79 -41.94 99.49 Favored 'General case' 0 CA--C 1.503 -0.841 0 CA-C-N 117.964 0.347 . . . . 0.0 110.648 178.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.93 -46.9 76.48 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.206 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -67.47 -37.52 83.04 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -67.41 -32.61 73.62 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.77 0.319 . . . . 0.0 110.265 177.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.34 -17.8 64.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 31.6 mt -105.84 12.06 31.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 2.9 mttt -54.81 129.01 35.56 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 176.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.27 -40.46 89.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 CA-C-O 122.809 1.29 . . . . 0.0 107.852 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -65.12 -28.48 69.46 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.81 -1.996 . . . . 0.0 113.441 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 69.5 m -162.26 75.45 2.17 Favored Pre-proline 0 N--CA 1.474 0.73 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -73.5 143.75 35.01 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 114.741 -3.039 . . . . 0.0 112.605 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -137.21 100.91 4.39 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.398 0.618 . . . . 0.0 110.09 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -59.5 -46.72 92.64 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.891 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -57.11 -32.06 65.92 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -69.9 -40.43 75.63 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 119.868 -0.733 . . . . 0.0 109.162 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.01 -48.33 74.3 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.033 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.1 mt -56.96 -44.38 82.55 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 117.944 0.338 . . . . 0.0 111.855 -176.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.2 t30 -61.6 -38.92 89.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.797 0.808 . . . . 0.0 111.541 179.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -69.72 -48.55 59.11 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.5 0.667 . . . . 0.0 109.791 178.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.44 -48.51 71.62 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.162 178.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.99 -35.82 79.65 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -175.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -46.73 61.68 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 176.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.04 -34.27 68.05 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.368 0.604 . . . . 0.0 110.247 -178.628 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.17 -17.47 68.08 Favored Glycine 0 C--O 1.241 0.533 0 N-CA-C 115.101 0.801 . . . . 0.0 115.101 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.8 t -110.99 -12.06 14.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 117.867 0.834 . . . . 0.0 110.081 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.1 mt -69.63 147.48 50.61 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 121.917 -0.489 . . . . 0.0 110.057 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -78.73 84.48 4.81 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-O 122.83 1.3 . . . . 0.0 108.965 177.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 28.4 m -99.05 46.32 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.1 t -66.16 169.69 6.73 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 -177.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 22.9 m -49.29 -29.4 5.88 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 114.266 1.209 . . . . 0.0 114.266 -174.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -55.62 -47.53 76.42 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.309 -0.244 . . . . 0.0 111.322 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -86.03 -39.84 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 CA-C-O 121.424 0.63 . . . . 0.0 109.513 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -36.53 77.2 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -175.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -66.64 -32.94 74.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.786 0.803 . . . . 0.0 111.384 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . 0.45 ' HZ3' ' CD ' ' A' ' 472' ' ' GLU . 11.7 ptmm? -92.5 -1.13 57.18 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.997 -1.002 . . . . 0.0 111.753 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -132.29 43.25 3.03 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.663 0.744 . . . . 0.0 112.457 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 21.2 p -64.44 -25.57 68.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.14 -32.2 73.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.725 0.774 . . . . 0.0 112.354 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.5 t -68.39 -41.34 83.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.6 t -63.39 -37.01 78.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 178.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.72 -38.22 89.63 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.535 177.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 99.2 m -74.85 -38.11 62.06 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 118.5 0.591 . . . . 0.0 110.455 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 65.1 mt -58.82 -34.15 71.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.98 0.419 . . . . 0.0 111.034 178.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -65.08 -29.19 70.05 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.755 -0.59 . . . . 0.0 111.26 175.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -73.14 -42.73 62.54 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 122.239 -0.288 . . . . 0.0 111.441 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 2.2 pt -78.87 -24.13 13.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.04 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.59 -14.09 38.72 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 121.736 -0.602 . . . . 0.0 112.187 176.611 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -118.72 18.69 13.35 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.357 0.663 . . . . 0.0 111.516 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -68.74 106.26 2.59 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -175.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -75.97 -23.23 55.33 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.54 -24.4 64.63 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -177.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -151.67 126.18 9.47 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.511 -0.475 . . . . 0.0 112.062 174.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 46.4 tptt -62.21 -50.13 73.0 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.408 -178.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -57.82 -39.82 78.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.251 0.548 . . . . 0.0 111.455 -174.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 54.8 t -56.1 -45.36 80.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 176.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.8 ttp -67.41 -43.41 81.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.542 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -64.24 -47.64 78.89 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.0 tptt -69.48 -37.94 77.47 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.669 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.82 -41.57 87.17 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.27 -51.09 67.57 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.599 -1.182 . . . . 0.0 113.322 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -44.71 90.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 -179.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.5 t -67.75 -50.0 64.45 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.998 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.179 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -54.58 -44.58 73.12 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.6 m -65.46 -39.04 91.54 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 122.925 0.49 . . . . 0.0 111.317 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 35.8 mtt-85 -57.74 -31.74 66.76 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 121.874 -0.516 . . . . 0.0 110.447 175.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 3.3 mt -76.69 -31.7 57.4 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -37.83 88.62 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.45 178.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--N 1.319 -0.721 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.502 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 C--O 1.22 -0.455 0 CA-C-O 120.822 0.344 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 51.8 t -54.31 -47.55 68.82 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.947 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -63.38 -33.9 76.56 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 122.525 0.33 . . . . 0.0 111.781 -178.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -68.36 -41.56 80.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 178.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -72.74 -32.72 65.89 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.842 -176.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -56.35 -35.61 67.85 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.698 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -54.7 -39.95 68.68 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.952 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 39.1 tttt -66.46 -54.3 25.68 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 176.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -47.36 85.66 Favored 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -176.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -61.01 -40.57 94.06 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 66.1 m -64.04 -41.93 97.24 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.424 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -63.91 -42.69 97.35 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-O 119.426 -0.321 . . . . 0.0 111.349 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.43 -46.44 70.48 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.272 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -68.09 -38.42 82.33 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -176.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -68.37 -31.19 70.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.709 0.29 . . . . 0.0 110.245 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -19.17 65.71 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.5 mt -105.84 12.15 31.1 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -55.62 129.41 38.96 Favored 'General case' 0 C--O 1.209 -1.038 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 177.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.7 t -63.15 -40.64 89.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 122.363 1.078 . . . . 0.0 108.504 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -68.43 -27.14 65.92 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 113.491 -1.686 . . . . 0.0 113.148 -178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 49.4 m -159.43 74.0 3.29 Favored Pre-proline 0 N--CA 1.47 0.563 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -176.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.45 145.93 43.59 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 114.701 -3.066 . . . . 0.0 112.372 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -137.3 91.74 2.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.523 0.678 . . . . 0.0 110.154 -176.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 1.1 p -57.37 -46.02 85.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -177.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -58.06 -31.36 66.98 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 120.843 0.354 . . . . 0.0 110.089 -177.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -70.9 -42.08 70.42 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 -177.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.26 -49.44 74.09 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 176.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 80.8 mt -57.01 -42.89 81.2 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -176.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -66.01 -38.35 88.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.297 0.57 . . . . 0.0 111.468 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -65.77 -48.25 72.45 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.658 0.742 . . . . 0.0 109.22 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.76 -44.52 81.85 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.552 177.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -62.41 -36.97 84.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 119.161 0.891 . . . . 0.0 112.32 -177.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -71.77 -43.92 64.9 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.8 -31.71 71.09 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.399 0.619 . . . . 0.0 110.246 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.82 -17.41 62.84 Favored Glycine 0 C--O 1.24 0.517 0 CA-C-O 119.507 -0.607 . . . . 0.0 114.494 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 12.2 t -114.85 -13.36 11.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.742 0.771 . . . . 0.0 111.048 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.2 mt -67.0 146.41 54.39 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -77.67 84.22 4.02 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 122.515 1.15 . . . . 0.0 110.17 178.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.9 m -98.27 47.56 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 CA-C-O 122.942 1.353 . . . . 0.0 109.079 -178.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.2 t -66.94 173.61 3.53 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 20.1 m -49.38 -32.99 12.61 Favored 'General case' 0 C--O 1.214 -0.794 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -173.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -55.44 -43.9 75.8 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 177.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -87.14 -41.85 14.94 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 CA-C-O 121.518 0.675 . . . . 0.0 109.32 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -38.08 81.32 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -174.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -67.62 -32.91 73.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.716 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -88.69 -7.38 56.42 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.671 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -123.49 40.58 3.69 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.122 0.487 . . . . 0.0 111.017 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 12.0 p -62.63 -29.53 70.69 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.638 -0.664 . . . . 0.0 112.766 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -63.17 -29.21 70.61 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.527 0.68 . . . . 0.0 111.633 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 46.9 t -71.45 -43.79 72.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 43.1 t -61.95 -39.99 85.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.02 76.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.293 177.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.8 m -77.57 -38.55 48.17 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 118.883 0.765 . . . . 0.0 109.939 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 55.1 mt -58.66 -34.32 71.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.148 0.499 . . . . 0.0 110.208 177.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 5.4 mtpp -61.73 -34.36 75.68 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.008 -0.432 . . . . 0.0 111.66 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -69.71 -45.51 68.08 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.728 0.299 . . . . 0.0 111.769 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 3.9 pt -78.42 -22.59 13.29 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -175.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -64.36 -12.28 40.82 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 121.903 -0.498 . . . . 0.0 112.168 175.367 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -121.38 18.95 11.39 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 122.604 0.361 . . . . 0.0 111.51 175.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -67.92 118.4 11.07 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -176.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -85.19 -26.15 26.94 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -177.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.63 -41.59 98.24 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.174 0.511 . . . . 0.0 111.367 -175.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -130.93 109.92 10.89 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.82 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -58.18 -39.31 78.61 Favored 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.801 178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -56.54 -42.79 79.09 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.385 0.612 . . . . 0.0 111.262 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 69.0 t -59.89 -44.06 93.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 29.3 ttm -57.98 -48.01 81.28 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 122.61 0.364 . . . . 0.0 110.4 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.68 -47.15 76.42 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -72.12 -37.31 69.5 Favored 'General case' 0 CA--C 1.513 -0.468 0 C-N-CA 118.148 -1.421 . . . . 0.0 110.778 -176.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.87 86.68 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.475 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.4 -49.92 71.89 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.04 -43.8 91.69 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 -178.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 65.1 t -69.18 -50.06 56.14 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.971 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.493 -176.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -54.31 -44.82 72.34 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.11 -0.329 . . . . 0.0 110.11 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.4 m -66.38 -36.22 82.31 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.914 0.486 . . . . 0.0 111.291 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 41.1 mtt-85 -60.47 -28.92 68.71 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.735 -0.603 . . . . 0.0 110.329 175.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 7.8 mt -76.77 -33.42 58.07 Favored 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -175.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -29.64 70.31 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.755 178.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--N 1.317 -0.828 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.173 176.913 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.9 m . . . . . 0 C--O 1.224 -0.238 0 CA-C-O 120.942 0.401 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 43.1 t -54.65 -48.02 72.15 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.14 0 O-C-N 122.042 -0.411 . . . . 0.0 111.824 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -60.25 -34.25 73.44 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -68.77 -42.89 76.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 122.166 0.984 . . . . 0.0 108.603 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -72.57 -34.84 67.75 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.332 -176.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.1 tt -57.0 -40.3 76.33 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.364 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -60.35 -37.18 79.87 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.59 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -68.72 -53.44 22.06 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.828 176.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -45.33 82.81 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 118.557 0.617 . . . . 0.0 112.191 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.4 t-160 -57.44 -43.78 84.18 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 48.7 m -64.63 -38.5 91.21 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -65.47 -35.8 81.97 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.046 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.4 -42.34 83.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.024 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -64.16 -45.25 89.29 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -65.13 -33.41 75.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.272 -178.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.83 -18.05 65.07 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 29.8 mt -108.56 12.08 26.26 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -177.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -54.49 129.69 36.94 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.8 t -62.94 -41.17 91.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 122.612 1.196 . . . . 0.0 107.819 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -65.63 -28.03 68.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.052 -1.886 . . . . 0.0 113.549 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 5.7 m -159.63 72.7 3.28 Favored Pre-proline 0 N--CA 1.473 0.691 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -176.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -73.4 143.01 34.18 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 114.281 -3.346 . . . . 0.0 112.509 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -137.22 100.44 4.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.581 0.705 . . . . 0.0 109.976 -178.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.7 -47.88 91.13 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.889 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -177.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -57.04 -32.05 65.78 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.9 ttt180 -68.84 -40.25 79.53 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 -177.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -49.81 69.12 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 175.696 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 60.9 mt -56.54 -44.36 80.81 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -175.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -62.82 -39.95 95.87 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.716 0.769 . . . . 0.0 111.206 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -70.88 -45.68 63.97 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 121.745 -0.597 . . . . 0.0 110.0 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.58 -49.51 70.2 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.594 177.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -61.89 -36.06 80.16 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -175.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.38 -46.44 66.92 Favored 'General case' 0 C--O 1.223 -0.337 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.94 -33.64 67.2 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.498 0.666 . . . . 0.0 109.951 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.23 -17.53 68.27 Favored Glycine 0 N--CA 1.452 -0.288 0 N-CA-C 115.115 0.806 . . . . 0.0 115.115 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.2 t -111.87 -11.44 13.91 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.989 0.895 . . . . 0.0 110.241 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.2 mt -69.37 148.67 49.33 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 121.896 -0.503 . . . . 0.0 109.822 179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -78.25 84.15 4.47 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-O 122.49 1.138 . . . . 0.0 108.864 177.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.2 m -98.55 47.22 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-O 123.21 1.481 . . . . 0.0 107.708 -178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.3 t -66.8 171.93 4.82 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 -178.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.7 m -49.15 -33.69 12.65 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -173.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -55.62 -44.79 77.38 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 176.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 3.9 mp -83.63 -42.48 17.48 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 CA-C-O 122.036 0.922 . . . . 0.0 108.611 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -37.7 76.56 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -176.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -67.11 -33.44 75.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.425 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -89.35 -9.74 49.27 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.248 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -125.08 41.7 3.45 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.516 0.674 . . . . 0.0 112.002 -175.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 22.8 p -62.24 -27.43 68.99 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -66.95 -26.54 66.88 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 43.0 t -71.71 -42.26 70.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.2 t -63.33 -37.35 79.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.57 -34.46 77.86 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.872 177.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.1 m -77.27 -39.84 46.72 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 118.072 0.396 . . . . 0.0 110.203 179.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 54.1 mt -58.24 -35.37 71.61 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.082 0.467 . . . . 0.0 110.929 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -63.32 -29.01 70.4 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.062 -0.399 . . . . 0.0 111.348 175.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -74.58 -42.95 57.83 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.3 pt -78.78 -23.38 13.0 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -17.13 47.63 Favored 'General case' 0 C--O 1.214 -0.784 0 O-C-N 121.994 -0.442 . . . . 0.0 111.955 176.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -118.68 19.13 13.3 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.01 0.524 . . . . 0.0 111.386 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -67.07 115.49 6.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.083 0.468 . . . . 0.0 111.992 -176.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -83.78 -21.99 32.0 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 -177.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -70.42 -22.45 62.72 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 120.527 -0.469 . . . . 0.0 112.119 -177.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -152.24 126.68 9.36 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.588 175.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.8 tptt -64.37 -47.8 77.9 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.555 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -57.75 -39.78 78.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.339 0.59 . . . . 0.0 111.347 -174.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 59.8 t -55.99 -45.15 80.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.121 176.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.2 ttp -65.87 -44.08 86.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.28 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.04 -46.69 80.2 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -69.43 -38.95 78.07 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.682 -0.807 . . . . 0.0 110.871 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.64 85.99 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -64.37 -50.98 65.56 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.439 -1.255 . . . . 0.0 113.361 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -42.13 89.53 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.55 -49.66 50.83 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.935 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.177 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -55.12 -44.82 75.37 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.5 m -66.4 -36.94 84.11 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 122.829 0.451 . . . . 0.0 110.997 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 5.7 mtt85 -58.32 -31.78 67.86 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.023 -0.423 . . . . 0.0 110.118 175.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 4.6 mt -76.64 -31.75 57.57 Favored 'General case' 0 CA--C 1.5 -0.958 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -176.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -38.86 92.59 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.153 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.2 m . . . . . 0 C--N 1.32 -0.699 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 178.137 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 C--O 1.225 -0.187 0 CA-C-O 121.098 0.475 . . . . 0.0 111.645 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 41.1 t -55.87 -47.57 79.54 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.858 0 O-C-N 122.109 -0.37 . . . . 0.0 111.656 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -63.53 -33.95 76.71 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -67.73 -42.32 82.1 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -69.66 -33.25 72.32 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.63 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.16 -38.95 71.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.741 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -53.86 -39.53 65.73 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.855 -178.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -70.9 -55.43 8.46 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.34 -47.72 78.23 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -60.95 -40.31 92.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 64.6 m -64.85 -42.0 95.25 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.921 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -62.99 -41.79 99.66 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.03 178.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -54.41 -48.45 68.87 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.021 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -65.9 -40.51 91.6 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -176.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -68.88 -26.59 65.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.655 0.264 . . . . 0.0 111.004 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -72.5 -17.68 61.73 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 178.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 25.0 mt -103.93 12.14 34.66 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -55.27 128.01 32.01 Favored 'General case' 0 C--O 1.21 -1.019 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 178.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 52.5 t -63.0 -40.46 89.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 122.117 0.96 . . . . 0.0 109.46 179.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -65.87 -31.64 72.69 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 113.981 -1.463 . . . . 0.0 112.691 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 17.2 t -159.8 78.19 2.76 Favored Pre-proline 0 C--O 1.246 0.877 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.799 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.29 148.73 44.18 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 115.832 -2.312 . . . . 0.0 112.153 178.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -137.32 97.72 3.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.61 0.719 . . . . 0.0 109.093 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 70.8 t -59.13 -42.85 87.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.676 -178.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -60.46 -35.64 76.35 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.492 0.587 . . . . 0.0 110.871 -177.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 40.7 ttm180 -65.1 -43.07 93.25 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.097 0.475 . . . . 0.0 109.933 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -65.27 -50.39 65.94 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 86.7 mt -56.9 -42.29 79.63 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 111.357 0.132 . . . . 0.0 111.357 -176.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -65.62 -38.57 89.81 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.35 0.595 . . . . 0.0 111.67 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -66.57 -47.18 73.6 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 177.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.35 -42.71 82.55 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.605 177.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -64.77 -37.15 86.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 119.073 0.851 . . . . 0.0 112.541 -177.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -69.83 -45.01 68.76 Favored 'General case' 0 C--O 1.225 -0.219 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 177.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.76 -35.31 68.49 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.291 0.567 . . . . 0.0 110.927 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.94 -19.27 67.53 Favored Glycine 0 C--O 1.24 0.506 0 N-CA-C 114.928 0.731 . . . . 0.0 114.928 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.3 t -109.06 -16.28 14.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 117.582 0.691 . . . . 0.0 110.091 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.7 mt -65.03 144.16 57.47 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.348 0.594 . . . . 0.0 109.935 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -78.12 84.52 4.35 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 122.01 0.91 . . . . 0.0 109.747 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 35.5 m -98.92 45.0 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-O 123.008 1.385 . . . . 0.0 108.03 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.45 173.69 3.16 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.148 -1.387 . . . . 0.0 107.691 -177.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.28 -32.44 10.88 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 -173.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.49 -45.11 77.04 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -88.66 -39.23 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 0 CA-C-O 121.2 0.524 . . . . 0.0 109.718 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -35.82 75.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -175.125 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -64.74 -32.81 74.66 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.567 0.698 . . . . 0.0 111.71 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -95.05 1.16 55.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.592 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -132.2 42.97 3.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.845 0.831 . . . . 0.0 111.917 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.0 p -65.22 -28.65 69.51 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 121.673 -0.642 . . . . 0.0 111.905 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -67.38 -26.21 66.35 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.547 0.689 . . . . 0.0 111.991 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 65.5 t -70.24 -43.86 78.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 178.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 44.0 t -62.49 -35.3 69.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 178.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.43 -39.88 94.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 119.018 -0.515 . . . . 0.0 111.203 177.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 99.3 m -73.57 -39.15 64.87 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 119.33 0.968 . . . . 0.0 109.911 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 62.7 mt -57.87 -35.31 70.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.791 0.329 . . . . 0.0 111.09 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -65.35 -29.04 69.73 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.751 -0.593 . . . . 0.0 111.548 175.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -73.15 -44.63 59.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.021 0.438 . . . . 0.0 110.631 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . 0.4 ' HA ' ' HB2' ' A' ' 529' ' ' TYR . 14.7 pt -78.26 -24.48 13.76 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.847 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -175.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.48 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -59.26 -19.37 45.4 Favored 'General case' 0 C--O 1.213 -0.833 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 176.039 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -118.67 19.12 13.31 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 122.911 0.484 . . . . 0.0 111.784 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . 0.4 ' HB2' ' HA ' ' A' ' 526' ' ' ILE . 7.9 t80 -73.19 104.62 4.31 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.232 0.539 . . . . 0.0 111.624 -176.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -68.32 -32.33 72.37 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 116.419 2.007 . . . . 0.0 116.419 -175.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.68 -44.33 94.05 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 122.195 0.998 . . . . 0.0 112.007 -176.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 67.1 m-20 -113.99 90.34 3.32 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 -174.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -53.22 -50.0 65.63 Favored 'General case' 0 C--O 1.207 -1.163 0 O-C-N 122.33 -0.231 . . . . 0.0 110.958 -179.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -58.9 -37.74 77.3 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.845 0.355 . . . . 0.0 111.625 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 42.7 t -57.62 -44.41 85.3 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.559 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -63.93 -44.94 91.38 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.53 -47.67 80.69 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -70.44 -40.24 73.89 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 119.552 -0.859 . . . . 0.0 110.648 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.89 -40.02 87.32 Favored 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.48 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -61.01 -49.41 77.51 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 178.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -44.31 95.66 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.54 -51.45 51.54 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.774 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.059 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -53.93 -46.2 71.46 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 122.787 0.435 . . . . 0.0 110.27 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 33.2 m -63.29 -38.96 93.21 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 122.966 0.506 . . . . 0.0 110.982 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -62.21 -29.75 70.6 Favored 'General case' 0 C--O 1.215 -0.734 0 O-C-N 121.69 -0.631 . . . . 0.0 110.803 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 5.2 mt -75.12 -30.73 60.92 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 -178.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -34.37 77.94 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.712 177.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 C--N 1.32 -0.674 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 177.357 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.9 m . . . . . 0 C--O 1.225 -0.231 0 CA-C-O 121.125 0.488 . . . . 0.0 112.189 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 38.0 t -54.17 -48.99 65.31 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.878 0 O-C-N 122.027 -0.421 . . . . 0.0 111.997 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -61.26 -34.2 74.78 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -67.47 -41.77 84.07 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -72.51 -35.47 68.12 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.942 -177.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 3.8 tt -58.29 -37.83 75.82 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.578 178.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -57.73 -41.87 82.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 118.593 0.633 . . . . 0.0 110.293 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -67.53 -53.17 30.79 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 120.378 -0.529 . . . . 0.0 110.089 178.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -44.7 86.47 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -58.31 -43.85 88.35 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.9 m -63.77 -37.66 88.19 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -65.78 -37.66 86.91 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.193 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -58.08 -45.51 88.35 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.115 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 24.4 mmtt -61.11 -45.63 93.9 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -64.17 -34.51 78.23 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.715 0.293 . . . . 0.0 110.639 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.73 -16.54 64.18 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.9 mt -109.99 12.11 23.8 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -56.78 130.62 46.39 Favored 'General case' 0 C--O 1.21 -1.024 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 46.2 t -62.5 -40.93 89.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 122.303 1.049 . . . . 0.0 108.863 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -67.19 -30.19 70.07 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.638 -1.619 . . . . 0.0 113.093 -178.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.6 t -160.93 76.4 2.53 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -175.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -75.54 146.46 30.81 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 116.896 -1.603 . . . . 0.0 113.053 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -137.21 99.96 4.13 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.447 0.641 . . . . 0.0 110.354 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.3 -46.17 81.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -58.43 -32.68 68.92 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 121.935 0.874 . . . . 0.0 109.773 -176.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -70.76 -39.87 73.01 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.325 -1.307 . . . . 0.0 108.835 -175.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.01 -50.14 65.29 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 175.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 79.2 mt -56.62 -43.09 79.88 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -175.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.74 -38.38 90.81 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.619 0.723 . . . . 0.0 111.868 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -71.24 -45.24 63.69 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 121.655 -0.653 . . . . 0.0 109.617 178.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.04 -48.14 73.82 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.804 177.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -62.33 -35.64 79.71 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -175.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -67.41 -49.4 63.96 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.96 -33.51 62.42 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.393 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.95 -18.52 70.78 Favored Glycine 0 C--O 1.24 0.471 0 N-CA-C 115.176 0.831 . . . . 0.0 115.176 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.5 t -109.95 -13.36 14.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 118.085 0.942 . . . . 0.0 110.225 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 5.2 mt -67.02 146.85 53.92 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 122.021 -0.424 . . . . 0.0 110.949 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -78.65 84.43 4.75 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-O 122.544 1.164 . . . . 0.0 109.103 177.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.0 m -98.82 47.39 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-O 122.968 1.366 . . . . 0.0 108.708 -178.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.8 t -66.78 172.34 4.42 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 106.824 -1.546 . . . . 0.0 106.824 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.0 m -49.17 -32.87 11.06 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -173.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -55.39 -44.81 76.49 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -85.75 -41.83 15.63 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.448 0 CA-C-O 121.774 0.797 . . . . 0.0 109.231 179.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.69 -37.51 79.04 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -175.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -65.39 -31.98 73.38 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.604 0.716 . . . . 0.0 112.203 -178.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -93.72 -6.12 46.89 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.085 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -127.93 39.97 3.76 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.533 0.682 . . . . 0.0 111.819 -178.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 28.2 p -63.8 -24.83 67.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -61.83 -32.54 72.87 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.475 0.655 . . . . 0.0 112.313 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 21.3 t -71.32 -40.99 74.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 31.7 t -62.86 -38.36 81.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.42 -30.2 71.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.948 177.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.6 m -82.58 -39.26 22.51 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 31.9 mt -57.56 -36.53 71.79 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.285 0.564 . . . . 0.0 110.881 178.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -62.44 -28.55 69.88 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 122.165 -0.335 . . . . 0.0 111.536 175.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -76.96 -42.18 40.12 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 178.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -78.76 -22.23 12.95 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.106 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -177.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.429 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -60.52 -18.12 50.02 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 122.431 0.292 . . . . 0.0 111.547 175.674 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -118.67 19.38 13.22 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.198 0.599 . . . . 0.0 111.571 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -66.64 110.35 3.18 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.195 0.521 . . . . 0.0 112.187 -176.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -74.39 -28.05 60.92 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.15 -41.67 94.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -175.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -131.94 111.05 11.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 -178.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -55.58 -44.24 76.73 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.045 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -55.9 -42.74 76.45 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.004 0.431 . . . . 0.0 112.058 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -57.56 -44.38 84.97 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -62.83 -44.49 96.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.063 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.25 -46.89 78.74 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.3 tptt -69.04 -39.66 79.07 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 119.1 -1.04 . . . . 0.0 111.071 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.72 -40.26 87.4 Favored 'General case' 0 C--O 1.212 -0.87 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.429 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.42 -50.44 71.49 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.287 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -45.5 89.72 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 60.6 t -67.11 -49.57 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.979 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.202 -177.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -56.01 -44.98 79.21 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 26.6 m -66.12 -35.63 81.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.295 0.569 . . . . 0.0 111.161 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 54.2 mtt-85 -61.27 -27.81 68.74 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 121.705 -0.622 . . . . 0.0 110.469 175.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 9.9 mt -76.48 -35.78 58.22 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -176.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . 0.468 ' HA ' ' HZ2' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -63.36 -28.01 69.71 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 114.735 -1.121 . . . . 0.0 111.432 178.32 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 C--N 1.314 -0.961 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.662 178.137 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.8 m . . . . . 0 C--O 1.223 -0.325 0 CA-C-O 120.819 0.342 . . . . 0.0 111.557 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 39.3 t -53.76 -48.41 61.25 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.05 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.16 -34.21 77.13 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.69 -39.92 88.32 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 179.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -74.16 -35.79 64.05 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.214 -178.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 5.2 tt -58.63 -38.68 78.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.047 -0.978 . . . . 0.0 109.332 178.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -55.21 -40.32 70.66 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -71.8 -53.61 12.81 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.27 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -45.84 79.47 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -178.32 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.9 t-160 -59.13 -41.94 89.44 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.5 m -65.21 -40.02 93.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 119.441 -0.314 . . . . 0.0 111.196 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -65.02 -40.51 94.98 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.368 178.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.9 mt -54.29 -48.5 67.35 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.06 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -65.89 -38.36 88.55 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -177.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -66.84 -32.35 73.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.664 0.269 . . . . 0.0 110.299 177.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -20.42 66.0 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.9 mt -101.15 12.05 38.32 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 12.6 mtpp -56.72 122.22 11.62 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 40.1 t -60.98 -39.04 80.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 122.481 1.134 . . . . 0.0 109.4 178.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -64.26 -28.21 69.57 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 113.525 -1.67 . . . . 0.0 112.811 -178.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -168.73 81.13 0.74 Allowed Pre-proline 0 N--CA 1.47 0.538 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.13 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.87 149.44 33.28 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 118.083 -0.811 . . . . 0.0 113.182 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -137.28 99.23 3.92 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.526 0.679 . . . . 0.0 110.871 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.96 -45.36 87.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -179.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -58.79 -32.13 69.05 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -69.49 -40.28 77.12 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.99 -49.92 66.1 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 176.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.64 -43.97 80.83 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -176.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -63.5 -37.45 87.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.565 0.698 . . . . 0.0 111.447 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -70.48 -47.49 60.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.365 0.603 . . . . 0.0 109.601 178.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.65 -49.01 71.61 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.227 178.021 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -61.73 -35.37 77.87 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -175.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -47.86 57.89 Favored 'General case' 0 C--O 1.224 -0.266 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 176.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.7 -34.02 67.04 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.401 0.62 . . . . 0.0 110.197 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.94 -17.89 68.09 Favored Glycine 0 C--O 1.236 0.259 0 N-CA-C 115.292 0.877 . . . . 0.0 115.292 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.9 t -110.86 -11.31 14.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 118.003 0.901 . . . . 0.0 110.235 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.7 mt -68.85 148.87 49.62 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 121.939 -0.475 . . . . 0.0 110.296 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -77.28 84.48 3.72 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 122.719 1.247 . . . . 0.0 109.087 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 31.1 m -100.28 50.18 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 CA-C-O 122.969 1.366 . . . . 0.0 108.167 -178.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.1 t -66.53 171.87 4.64 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 40.4 m -49.32 -31.49 9.27 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -175.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -55.43 -45.08 76.8 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.1 mp -86.05 -42.88 16.19 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -37.98 81.82 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -175.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -69.23 -30.29 68.41 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.219 -178.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -89.16 -5.24 57.88 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 122.187 -0.321 . . . . 0.0 110.901 177.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -129.87 43.95 3.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.591 0.71 . . . . 0.0 112.426 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.8 p -63.66 -25.27 68.14 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.08 -31.61 72.91 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.001 0.905 . . . . 0.0 111.922 178.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 57.8 t -69.53 -42.84 80.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 179.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 26.5 t -62.72 -38.07 80.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.93 -39.05 93.41 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.334 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 92.6 m -73.68 -38.08 65.03 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 118.483 0.583 . . . . 0.0 110.464 -178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 63.1 mt -58.7 -35.75 73.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.136 0.493 . . . . 0.0 110.593 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -65.77 -29.14 69.6 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.878 -0.514 . . . . 0.0 111.357 175.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -72.22 -45.51 59.97 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.915 0.388 . . . . 0.0 110.808 178.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 16.6 pt -78.75 -20.61 12.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.806 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 -176.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.4 OUTLIER -62.45 -17.56 59.69 Favored 'General case' 0 C--O 1.213 -0.864 0 O-C-N 121.783 -0.573 . . . . 0.0 111.897 176.022 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.7 19.35 13.21 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.217 0.607 . . . . 0.0 111.411 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -65.5 114.65 5.03 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.024 0.44 . . . . 0.0 111.943 -177.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -75.2 -29.92 60.48 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.45 -40.72 96.26 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -132.57 112.1 11.79 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.23 -178.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 40.2 tptt -56.67 -43.69 80.64 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.388 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -55.74 -43.27 76.46 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.189 0.441 . . . . 0.0 112.189 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 67.4 t -57.35 -44.51 84.35 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -63.85 -43.53 95.85 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.99 -47.94 75.74 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.858 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -69.28 -38.98 78.6 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 118.864 -1.134 . . . . 0.0 110.586 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.37 -41.26 88.88 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-O 121.442 0.639 . . . . 0.0 109.498 178.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.427 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.91 -48.25 77.34 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.913 -1.04 . . . . 0.0 112.924 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -41.51 92.58 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 52.8 t -70.6 -51.25 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.286 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -54.63 -45.9 73.83 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 122.499 0.32 . . . . 0.0 110.278 -177.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 16.0 m -65.78 -34.61 78.56 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.289 0.566 . . . . 0.0 111.197 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.01 -28.76 70.32 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 121.803 -0.561 . . . . 0.0 109.966 175.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 9.1 mt -76.57 -33.33 58.49 Favored 'General case' 0 C--O 1.207 -1.143 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 -176.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -27.28 69.15 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.208 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 C--N 1.315 -0.915 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.866 177.751 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.7 m . . . . . 0 C--O 1.224 -0.269 0 CA-C-O 120.733 0.301 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 51.7 t -55.86 -46.77 80.21 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 CA-C-O 120.879 0.371 . . . . 0.0 111.626 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.92 -34.1 77.36 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -67.92 -40.86 83.33 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 176.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -69.14 -34.66 75.37 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.035 -178.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -56.09 -39.9 72.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.398 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -53.4 -39.7 64.51 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.995 -178.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -70.69 -56.49 6.29 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.619 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -45.8 86.04 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -176.118 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -59.49 -42.65 92.61 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 58.5 m -63.59 -38.45 91.17 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.075 0.234 . . . . 0.0 111.306 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -64.25 -38.25 90.39 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.649 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 92.5 mt -59.93 -41.73 87.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.088 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 51.6 mmtt -64.5 -45.22 88.2 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 121.832 -0.543 . . . . 0.0 112.068 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -65.77 -32.17 73.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.712 0.292 . . . . 0.0 110.794 -178.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.63 -16.97 64.58 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 178.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 34.5 mt -111.21 12.3 21.8 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -177.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -54.19 133.33 44.38 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 177.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 63.5 t -63.81 -42.32 95.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 122.264 1.031 . . . . 0.0 108.393 176.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -68.29 -28.32 67.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.735 -1.575 . . . . 0.0 113.597 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 20.3 m -157.59 73.53 4.25 Favored Pre-proline 0 N--CA 1.472 0.645 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -72.25 143.37 39.38 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 115.194 -2.737 . . . . 0.0 112.204 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -137.28 100.65 4.31 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.689 0.756 . . . . 0.0 110.563 -178.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -47.28 91.58 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.867 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -57.59 -31.85 66.59 Favored 'General case' 0 CA--C 1.506 -0.716 0 O-C-N 123.301 0.376 . . . . 0.0 110.04 -177.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -70.88 -39.4 72.87 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -177.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.1 -48.96 69.2 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.86 -42.38 79.65 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.489 0.185 . . . . 0.0 111.314 -175.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -67.01 -36.8 82.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.44 0.638 . . . . 0.0 112.125 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -69.78 -45.86 67.05 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.45 -44.1 80.14 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.746 -1.116 . . . . 0.0 111.086 178.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -63.41 -37.39 87.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 119.156 0.889 . . . . 0.0 112.616 -177.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -70.51 -44.84 66.76 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 177.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.31 -35.79 67.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.237 0.541 . . . . 0.0 111.323 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.62 -20.35 69.95 Favored Glycine 0 C--O 1.24 0.506 0 N-CA-C 114.779 0.671 . . . . 0.0 114.779 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.2 t -107.14 -16.01 14.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 117.338 0.569 . . . . 0.0 110.081 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -65.47 145.53 56.01 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -80.09 79.59 6.62 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-O 122.542 1.163 . . . . 0.0 109.167 178.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 29.6 m -94.07 47.18 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 CA-C-O 122.991 1.377 . . . . 0.0 107.628 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.21 173.69 3.02 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 -178.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 13.8 m -48.32 -34.98 11.44 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 -173.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -54.86 -44.19 73.79 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 177.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -87.68 -38.74 12.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -36.75 79.91 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -175.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -65.88 -32.29 73.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.385 0.612 . . . . 0.0 111.983 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -93.24 -1.64 55.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.493 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -129.46 44.94 2.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.815 0.817 . . . . 0.0 112.099 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 23.7 p -65.51 -28.18 69.01 Favored 'General case' 0 C--N 1.32 -0.678 0 O-C-N 121.746 -0.596 . . . . 0.0 112.132 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -66.74 -27.21 67.43 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.663 0.744 . . . . 0.0 111.838 177.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.7 t -70.72 -43.6 77.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.8 t -63.53 -37.17 78.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.32 -33.71 76.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.918 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 80.1 m -78.69 -40.27 34.34 Favored 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 40.2 mt -57.61 -35.4 70.4 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.124 0.488 . . . . 0.0 110.933 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.04 -26.92 68.78 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.895 -0.503 . . . . 0.0 111.886 175.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -76.47 -43.38 40.1 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.2 pt -78.81 -22.08 12.9 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.988 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -177.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.455 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -64.49 -12.1 40.63 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 175.317 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -121.14 19.32 11.56 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.821 0.448 . . . . 0.0 110.474 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.7 112.78 3.0 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.494 0.664 . . . . 0.0 112.497 -174.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -78.37 -31.42 48.48 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.55 -26.96 65.68 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -175.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.6 122.35 10.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.164 0.507 . . . . 0.0 112.354 176.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -64.15 -40.4 96.07 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -61.85 -40.86 96.82 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.552 0.692 . . . . 0.0 109.986 -176.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.3 t -58.03 -43.21 84.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.089 176.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 32.5 ttm -59.73 -48.64 80.85 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-O 120.8 0.333 . . . . 0.0 110.852 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -68.14 -45.72 72.82 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -178.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 44.7 tptt -69.51 -38.5 77.61 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 118.931 -1.107 . . . . 0.0 110.482 -177.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -60.13 -38.93 84.54 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.455 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.62 -48.91 70.65 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.716 -1.129 . . . . 0.0 113.981 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -40.5 87.79 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 61.9 t -70.59 -53.02 24.16 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.867 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.563 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -53.8 -45.1 70.63 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 122.372 0.269 . . . . 0.0 111.22 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 25.3 m -65.05 -36.98 86.08 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.171 0.588 . . . . 0.0 111.157 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 37.2 mtt85 -62.08 -29.96 70.67 Favored 'General case' 0 C--O 1.216 -0.674 0 O-C-N 121.563 -0.711 . . . . 0.0 110.59 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 4.7 mt -76.38 -31.12 57.82 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -175.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . 0.465 ' HA ' ' HZ2' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -61.94 -42.49 99.17 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 175.722 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 18.0 m . . . . . 0 C--N 1.319 -0.75 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 178.553 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.223 -0.303 0 CA-C-O 120.959 0.409 . . . . 0.0 111.798 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 41.1 t -53.63 -46.09 60.67 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.947 0 O-C-N 122.016 -0.427 . . . . 0.0 112.103 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.03 -34.14 77.73 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -67.54 -40.2 85.03 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -73.07 -32.72 65.21 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.228 -177.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -57.43 -39.34 76.02 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.062 178.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -53.2 -39.83 63.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.87 0.304 . . . . 0.0 110.268 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -71.72 -57.28 4.51 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.866 177.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.79 -45.88 78.12 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -176.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -59.31 -42.01 90.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.9 m -65.14 -37.78 88.51 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 123.13 0.268 . . . . 0.0 111.476 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -64.74 -37.05 86.3 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.961 -0.695 . . . . 0.0 110.279 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -59.1 -42.58 86.99 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.063 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -62.51 -46.87 86.46 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -65.35 -33.13 75.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.89 0.376 . . . . 0.0 111.224 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.01 -17.32 64.61 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.6 mt -110.48 12.0 22.99 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -176.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -55.3 130.06 40.89 Favored 'General case' 0 C--O 1.208 -1.094 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 177.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 51.0 t -63.01 -40.49 89.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 122.267 1.032 . . . . 0.0 108.88 178.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.17 -29.87 69.68 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.756 -1.565 . . . . 0.0 113.011 -178.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 18.1 t -161.45 78.97 2.16 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.56 146.17 34.27 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 118.11 -0.794 . . . . 0.0 112.767 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -137.28 101.17 4.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.679 0.752 . . . . 0.0 110.804 -179.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -60.05 -45.26 95.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -179.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -61.76 -31.08 71.25 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -69.19 -41.3 77.33 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -178.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -65.0 -48.29 74.48 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 73.7 mt -56.69 -44.96 82.01 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.18 -41.0 97.93 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.799 0.809 . . . . 0.0 110.053 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.11 -48.16 68.97 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.339 0.59 . . . . 0.0 109.847 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.5 -45.76 84.54 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.379 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -63.25 -35.37 80.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 119.006 0.821 . . . . 0.0 112.475 -176.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -71.82 -43.8 64.98 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 177.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.18 -33.86 65.67 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.511 0.672 . . . . 0.0 110.657 177.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.1 -16.42 66.6 Favored Glycine 0 C--O 1.239 0.411 0 CA-C-O 119.204 -0.775 . . . . 0.0 114.526 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.8 t -113.9 -14.3 12.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 118.042 0.921 . . . . 0.0 110.889 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.5 mt -66.48 145.97 55.06 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.877 -0.514 . . . . 0.0 109.829 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -79.11 84.42 5.09 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 122.836 1.303 . . . . 0.0 109.566 178.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.8 m -96.59 48.76 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-O 123.18 1.467 . . . . 0.0 107.996 -178.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.5 t -66.84 172.23 4.57 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 -178.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 2.7 m -49.26 -34.88 16.19 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -173.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -54.72 -44.63 73.67 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 177.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -86.12 -41.66 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -38.86 82.51 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -175.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -69.33 -31.94 70.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.824 -177.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -88.42 -3.96 58.73 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.232 177.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -127.52 45.34 2.75 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.858 0.837 . . . . 0.0 112.465 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 17.5 p -64.91 -28.71 69.72 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 121.699 -0.626 . . . . 0.0 112.568 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -69.7 -22.5 63.41 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.503 0.668 . . . . 0.0 112.09 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 87.9 t -71.55 -45.17 69.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 177.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 50.6 t -62.94 -36.79 77.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.57 79.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.407 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.1 m -77.63 -39.08 46.42 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 118.47 0.577 . . . . 0.0 109.698 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 48.8 mt -59.11 -31.89 69.34 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.064 0.459 . . . . 0.0 111.464 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -64.73 -29.11 70.08 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.757 -0.589 . . . . 0.0 111.199 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -74.58 -42.59 58.46 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.3 pt -78.8 -22.42 12.92 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.905 0 N-CA-C 114.919 1.452 . . . . 0.0 114.919 -176.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.446 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -60.92 -18.8 58.83 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-O 120.845 0.355 . . . . 0.0 111.649 176.151 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -118.85 19.51 13.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.18 0.592 . . . . 0.0 111.508 178.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -66.8 118.48 10.38 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 122.661 0.384 . . . . 0.0 111.168 -178.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 44.1 mttp -83.13 -26.24 31.16 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 116.003 1.853 . . . . 0.0 116.003 -176.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.03 -40.57 96.62 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.614 -0.435 . . . . 0.0 111.564 -175.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -133.02 116.2 16.09 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.189 -178.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.9 tptt -57.48 -43.44 84.09 Favored 'General case' 0 C--O 1.21 -1.003 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -52.3 -45.91 65.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.077 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.8 t -58.52 -44.08 88.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.2 ttp -64.17 -44.31 92.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.32 -48.43 78.05 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.849 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.0 tptt -71.67 -38.62 70.63 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 118.315 -1.354 . . . . 0.0 111.961 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.04 -40.04 79.9 Favored 'General case' 0 C--O 1.212 -0.899 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.446 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.64 -51.07 68.7 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.09 178.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.59 -43.6 89.56 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 60.3 t -67.86 -51.27 51.8 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.809 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.233 -177.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -54.67 -44.87 73.7 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.653 0.263 . . . . 0.0 110.41 -177.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 40.5 m -63.81 -38.6 91.72 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 123.641 0.776 . . . . 0.0 111.315 179.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 66.2 mtt180 -61.69 -28.58 69.5 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 121.62 -0.675 . . . . 0.0 111.061 176.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 5.8 mt -76.52 -31.83 57.89 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 -176.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . 0.441 ' HA ' ' HZ3' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -61.25 -38.58 87.21 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.239 177.194 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 C--N 1.321 -0.663 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 178.275 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 C--O 1.224 -0.251 0 CA-C-O 120.975 0.417 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 44.4 t -54.84 -46.92 75.43 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.049 0 O-C-N 122.047 -0.408 . . . . 0.0 111.539 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -61.03 -34.21 74.5 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -68.19 -41.42 81.44 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.15 0.976 . . . . 0.0 108.453 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -73.32 -34.89 65.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.927 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.6 tt -57.57 -37.99 74.09 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.663 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.36 -38.65 80.97 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.286 -0.565 . . . . 0.0 110.205 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -68.44 -53.34 24.24 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 176.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.27 -45.77 87.25 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 17.6 t-160 -58.8 -42.84 90.05 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 65.7 m -63.59 -41.71 98.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 119.573 -0.251 . . . . 0.0 111.195 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -63.79 -40.84 97.63 Favored 'General case' 0 CA--C 1.501 -0.92 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.28 178.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.54 -45.8 71.29 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.039 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -68.08 -39.13 82.99 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -67.75 -31.38 71.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.998 0.428 . . . . 0.0 110.408 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.06 -18.61 64.72 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 122.633 0.373 . . . . 0.0 111.807 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 27.0 mt -107.39 12.16 28.27 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -54.91 129.77 38.79 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.0 t -61.25 -40.08 84.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 122.474 1.13 . . . . 0.0 108.852 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -66.33 -28.76 68.92 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 113.398 -1.728 . . . . 0.0 112.676 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 22.9 t -159.59 76.99 2.95 Favored Pre-proline 0 C--O 1.24 0.577 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -73.43 141.61 31.91 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 114.979 -2.881 . . . . 0.0 112.29 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -137.27 105.1 5.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.491 0.662 . . . . 0.0 110.444 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.81 -44.18 96.99 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -58.71 -32.69 69.41 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -178.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 22.7 ttp180 -68.51 -41.0 80.59 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.0 -48.98 64.27 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.89 -44.07 81.95 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -61.91 -38.22 87.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.654 0.74 . . . . 0.0 111.704 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -70.93 -47.46 58.93 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.499 0.666 . . . . 0.0 109.704 178.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -47.89 73.83 Favored 'General case' 0 N--CA 1.428 -1.537 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.115 178.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -61.4 -35.74 78.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.434 0.902 . . . . 0.0 113.434 -175.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.65 -46.13 59.93 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.49 -33.87 68.48 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.337 0.589 . . . . 0.0 109.872 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.64 -16.65 68.05 Favored Glycine 0 C--O 1.239 0.429 0 N-CA-C 115.034 0.774 . . . . 0.0 115.034 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.4 t -112.76 -7.93 13.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 118.136 0.968 . . . . 0.0 111.017 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.7 mt -71.89 148.93 45.62 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -79.4 84.33 5.32 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 122.757 1.265 . . . . 0.0 109.452 178.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 30.2 m -98.3 48.3 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 CA-C-O 123.028 1.394 . . . . 0.0 107.93 -178.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.0 t -66.24 172.44 3.89 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 -178.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 20.2 m -49.32 -33.25 12.84 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -174.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -55.48 -44.35 76.4 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 178.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -86.63 -41.4 14.89 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 CA-C-O 121.502 0.668 . . . . 0.0 109.348 179.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -38.47 80.48 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -176.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -63.85 -31.37 72.52 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.641 0.734 . . . . 0.0 112.446 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -95.38 -5.87 42.29 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.447 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -127.91 39.25 3.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.465 0.65 . . . . 0.0 111.296 -178.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.8 p -62.56 -25.48 68.08 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -178.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.36 -31.78 73.02 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.424 0.631 . . . . 0.0 112.155 178.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 41.3 t -71.15 -40.87 75.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.4 t -62.5 -37.75 79.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 178.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.69 92.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.38 177.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.5 m -73.68 -37.99 65.05 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 118.383 0.538 . . . . 0.0 110.536 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 68.6 mt -59.36 -34.51 72.49 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.929 0.395 . . . . 0.0 110.815 178.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -65.57 -29.04 69.6 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.807 -0.558 . . . . 0.0 111.212 175.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -71.21 -45.88 62.38 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 120.816 0.341 . . . . 0.0 110.986 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 5.3 pt -78.79 -20.4 12.98 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.987 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -177.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.444 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.97 -12.48 38.08 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 121.678 -0.638 . . . . 0.0 112.537 176.919 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -118.83 15.78 13.47 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 122.527 0.331 . . . . 0.0 111.57 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -63.32 122.85 17.21 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.203 0.525 . . . . 0.0 112.005 -176.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -92.38 -26.3 18.11 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 116.484 2.031 . . . . 0.0 116.484 -177.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -62.7 -42.29 99.56 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.719 0.771 . . . . 0.0 110.559 -176.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -129.6 111.88 13.15 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -61.02 -38.05 84.73 Favored 'General case' 0 C--O 1.209 -1.038 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.731 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -57.15 -41.96 80.11 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 55.0 t -56.45 -43.28 77.4 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 6.9 ttp -66.47 -40.11 89.17 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 122.369 0.268 . . . . 0.0 110.759 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.24 -51.38 63.92 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 123.086 0.241 . . . . 0.0 110.368 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -70.16 -38.29 75.42 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 119.401 -0.92 . . . . 0.0 111.239 -177.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.35 -40.71 82.92 Favored 'General case' 0 C--O 1.213 -0.868 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.444 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.51 -47.79 74.75 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.896 -1.047 . . . . 0.0 112.854 179.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -42.59 92.13 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.1 t -70.59 -49.72 50.2 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.085 0 C-N-CA 122.883 0.473 . . . . 0.0 111.61 -177.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -55.63 -44.97 77.62 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -178.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.3 m -66.71 -36.29 82.15 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 122.792 0.437 . . . . 0.0 110.889 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 9.3 mtt85 -58.84 -30.21 67.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.979 -0.451 . . . . 0.0 110.263 175.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 8.7 mt -76.63 -34.79 58.32 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -176.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -30.45 70.73 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.674 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 C--N 1.318 -0.796 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.428 177.306 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.2 m . . . . . 0 C--O 1.223 -0.314 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 41.9 t -53.9 -46.75 64.59 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -62.09 -34.16 75.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.74 0.305 . . . . 0.0 111.566 -177.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.47 -41.9 79.49 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -73.17 -34.09 65.83 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.281 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 3.0 tt -58.95 -35.87 73.87 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.481 178.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -59.11 -40.18 84.56 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.906 -0.718 . . . . 0.0 109.647 178.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -67.29 -54.16 23.25 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.151 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -45.18 81.53 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -58.89 -41.8 88.03 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 57.4 m -65.3 -39.31 92.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 119.406 -0.331 . . . . 0.0 111.649 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 -64.49 -41.01 96.71 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.846 178.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.88 -47.22 75.78 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.214 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 177.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -65.79 -38.43 88.98 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -67.3 -34.01 76.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.866 0.365 . . . . 0.0 110.414 177.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.6 -17.45 64.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.0 mt -107.28 11.93 28.71 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -177.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -57.2 129.69 42.88 Favored 'General case' 0 CA--C 1.497 -1.081 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 16.1 m -71.32 -19.53 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.079 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.942 -178.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.84 -27.91 30.51 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 113.47 -1.695 . . . . 0.0 110.823 -179.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 77.4 p -163.76 79.19 1.57 Allowed Pre-proline 0 C--O 1.241 0.623 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.897 -176.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -73.49 147.84 41.68 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 115.493 -2.538 . . . . 0.0 112.782 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -137.28 100.09 4.16 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.751 0.786 . . . . 0.0 109.726 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.5 -47.6 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.838 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -177.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -60.69 -30.15 69.75 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 -177.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.2 ttt180 -68.32 -41.59 80.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.38 -47.74 78.1 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 86.2 mt -57.37 -44.47 84.45 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -176.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -38.49 89.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.772 0.796 . . . . 0.0 110.115 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -69.16 -48.32 62.58 Favored 'General case' 0 C--N 1.321 -0.631 0 O-C-N 121.693 -0.629 . . . . 0.0 110.078 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -48.25 76.72 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.882 178.255 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -62.15 -35.71 79.61 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -175.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -72.78 -43.09 63.24 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 119.02 -1.072 . . . . 0.0 108.602 177.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.48 -35.82 70.67 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.237 0.541 . . . . 0.0 110.325 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.8 -18.81 68.85 Favored Glycine 0 C--O 1.242 0.602 0 N-CA-C 114.996 0.758 . . . . 0.0 114.996 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.8 t -109.27 -10.31 14.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 117.717 0.758 . . . . 0.0 110.293 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.4 mt -71.16 148.89 46.92 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -79.76 84.26 5.59 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 122.261 1.029 . . . . 0.0 109.264 178.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 35.5 m -98.54 47.73 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.163 0 CA-C-O 123.344 1.545 . . . . 0.0 108.188 -178.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 13.3 t -68.16 173.73 4.47 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.5 m -49.37 -33.76 14.41 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -173.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -53.91 -43.43 69.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 177.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -88.63 -41.77 14.31 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 CA-C-O 121.979 0.895 . . . . 0.0 109.431 179.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -39.47 81.3 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -175.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -67.55 -32.43 73.19 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.649 -178.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -89.11 -10.02 48.89 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.935 -0.306 . . . . 0.0 111.202 179.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -125.65 40.99 3.62 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.484 0.659 . . . . 0.0 112.163 -176.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 23.8 p -63.51 -24.45 67.82 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -62.15 -31.82 72.36 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.022 0.439 . . . . 0.0 112.024 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 23.6 t -71.11 -40.27 75.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 49.0 t -62.56 -36.83 76.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 178.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.82 -37.52 87.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.825 177.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.5 m -75.89 -38.38 57.87 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 118.531 0.605 . . . . 0.0 110.017 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 46.4 mt -57.78 -34.96 70.16 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.951 0.405 . . . . 0.0 111.417 178.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -65.33 -29.09 69.79 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 121.976 -0.453 . . . . 0.0 111.376 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -73.7 -44.32 56.82 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.733 0.301 . . . . 0.0 111.189 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -78.23 -22.14 13.46 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.877 0 N-CA-C 114.323 1.231 . . . . 0.0 114.323 -176.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.4 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -62.6 -16.03 54.4 Favored 'General case' 0 C--O 1.214 -0.793 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 176.555 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -118.65 19.28 13.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.044 0.538 . . . . 0.0 111.61 177.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -69.5 95.11 0.8 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -63.64 -27.59 69.34 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -178.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.5 -31.06 72.11 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -176.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -144.77 108.24 4.63 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.7 tptt -53.96 -46.27 71.57 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.043 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -55.92 -43.42 77.35 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.038 0.446 . . . . 0.0 111.992 -176.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.53 -44.76 85.54 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.491 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.3 ttp -64.72 -42.85 94.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 119.283 -0.389 . . . . 0.0 110.279 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -64.52 -48.36 75.41 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.828 179.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -68.88 -39.16 79.96 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 118.978 -1.089 . . . . 0.0 110.908 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.18 83.84 Favored 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 109.084 -0.709 . . . . 0.0 109.084 177.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.99 -48.21 71.99 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.868 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -42.12 93.64 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.9 t -70.52 -51.43 37.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.921 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.578 -178.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -54.07 -44.84 71.46 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 -177.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.7 m -66.17 -34.84 78.96 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 123.111 0.564 . . . . 0.0 111.638 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 26.1 mtt85 -62.45 -31.18 71.86 Favored 'General case' 0 C--O 1.217 -0.648 0 O-C-N 121.771 -0.581 . . . . 0.0 109.698 175.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 5.7 mt -75.03 -34.69 61.91 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -176.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -59.79 -33.43 71.71 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.392 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--N 1.322 -0.589 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 179.753 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.1 m . . . . . 0 C--O 1.224 -0.255 0 CA-C-O 121.307 0.575 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 53.3 t -56.08 -47.23 80.74 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.771 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -64.08 -34.24 77.58 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -67.27 -43.64 81.33 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.991 0.901 . . . . 0.0 108.783 177.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 24.8 mttt -69.04 -34.27 74.94 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.0 -178.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -58.63 -36.98 74.93 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.355 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -54.92 -40.78 70.23 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.04 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 62.6 tttt -68.97 -55.06 12.06 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 176.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.23 -46.87 79.37 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -176.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -60.88 -40.61 93.65 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.0 m -63.98 -41.89 97.39 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.549 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -63.12 -42.89 99.61 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 118.004 0.365 . . . . 0.0 110.872 178.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.63 -47.49 72.49 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -67.2 -37.32 83.47 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -177.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -67.15 -33.73 76.05 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.0 -17.36 64.89 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 27.9 mt -107.06 12.08 28.94 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -56.05 132.42 50.05 Favored 'General case' 0 C--O 1.21 -1.006 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 177.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.84 -41.1 91.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 175.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -65.55 -28.76 69.39 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.056 -1.884 . . . . 0.0 113.782 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 19.0 m -159.93 72.85 3.15 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -176.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.41 141.49 28.58 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 114.18 -3.413 . . . . 0.0 112.27 179.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -137.27 100.15 4.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.579 0.704 . . . . 0.0 110.214 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -58.16 -46.55 88.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -57.87 -31.93 67.19 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -178.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -70.82 -39.88 72.79 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 -176.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.42 -48.61 72.21 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.6 mt -56.83 -42.94 80.52 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -176.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -65.0 -38.44 90.97 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.424 0.63 . . . . 0.0 111.836 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -68.42 -47.53 67.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.579 0.704 . . . . 0.0 109.582 178.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -48.11 73.95 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.875 177.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -63.96 -34.12 77.26 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -175.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -69.56 -46.88 65.37 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 176.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -58.44 -33.6 69.89 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.191 0.52 . . . . 0.0 110.901 -178.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.81 -18.29 63.95 Favored Glycine 0 C--O 1.235 0.191 0 CA-C-O 119.451 -0.638 . . . . 0.0 114.359 179.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.1 t -111.36 -12.44 14.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.911 0.856 . . . . 0.0 110.466 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.9 mt -68.87 146.48 52.79 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.982 -0.448 . . . . 0.0 110.228 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -79.22 84.4 5.18 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 122.762 1.267 . . . . 0.0 110.21 178.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.0 m -96.19 45.8 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 CA-C-O 122.8 1.286 . . . . 0.0 109.11 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.1 t -66.47 171.31 5.08 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -177.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.5 m -49.26 -30.19 6.9 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -174.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -55.43 -45.71 76.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.522 0.201 . . . . 0.0 111.475 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.75 -40.3 13.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.283 0.563 . . . . 0.0 109.819 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.91 -34.93 75.42 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -174.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -64.62 -31.68 73.01 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.786 0.803 . . . . 0.0 111.817 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -95.34 -3.04 47.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.899 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -126.19 38.91 4.05 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.163 0.506 . . . . 0.0 110.526 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.5 p -63.81 -29.27 70.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -63.58 -26.74 68.83 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.586 0.708 . . . . 0.0 111.83 177.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 38.4 t -71.66 -42.85 71.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.2 t -62.82 -35.96 73.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.11 85.69 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.06 176.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 98.0 m -77.91 -38.54 45.44 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 118.958 0.799 . . . . 0.0 110.011 -179.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 45.0 mt -57.52 -35.13 69.87 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.01 0.433 . . . . 0.0 111.393 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -64.95 -29.03 69.93 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.948 -0.47 . . . . 0.0 111.538 175.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -73.43 -45.14 56.26 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.768 0.318 . . . . 0.0 111.259 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -77.06 -23.4 14.82 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.923 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -176.405 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.438 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.2 OUTLIER -60.2 -19.32 53.69 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 176.413 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -118.64 19.32 13.27 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.093 0.557 . . . . 0.0 111.897 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -63.59 109.68 1.74 Allowed 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -176.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -72.51 -29.27 63.46 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -177.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.65 -24.84 64.58 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -174.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -150.79 119.25 6.44 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.774 -0.371 . . . . 0.0 110.422 178.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -61.38 -45.94 92.27 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.121 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -56.89 -40.36 76.1 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.185 0.517 . . . . 0.0 111.515 -175.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.7 t -56.05 -45.09 80.34 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -64.55 -43.93 92.37 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 119.12 -0.467 . . . . 0.0 110.08 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.54 -47.59 78.21 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.305 -0.558 . . . . 0.0 111.99 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -68.72 -40.28 80.0 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 119.627 -0.829 . . . . 0.0 110.934 -178.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.94 86.89 Favored 'General case' 0 C--O 1.213 -0.852 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.438 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.12 -48.79 74.71 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.354 -0.839 . . . . 0.0 113.15 179.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -43.96 95.0 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 59.0 t -68.69 -50.13 58.14 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.676 -178.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -54.68 -45.03 73.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.657 0.265 . . . . 0.0 110.374 -177.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 10.3 m -67.15 -34.13 76.92 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.755 0.312 . . . . 0.0 111.273 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -60.76 -28.94 69.09 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.613 -0.68 . . . . 0.0 109.732 175.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 9.2 mt -76.39 -34.24 58.87 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -174.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . 0.441 ' HA ' ' HZ2' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -62.86 -29.09 70.48 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.418 178.478 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 C--N 1.317 -0.827 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.456 176.822 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 8.9 m . . . . . 0 C--O 1.224 -0.251 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 35.6 t -53.86 -47.13 64.14 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.132 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -64.7 -34.31 78.01 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 120.718 0.294 . . . . 0.0 111.41 -176.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -67.25 -41.33 85.78 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -73.27 -33.61 65.35 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.891 -176.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 5.0 tt -56.74 -35.58 68.77 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.005 178.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -55.5 -41.02 72.49 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.253 0.479 . . . . 0.0 110.634 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -66.38 -54.68 21.59 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 177.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -47.23 85.18 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -176.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -58.98 -43.08 91.34 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 62.2 m -64.13 -39.03 93.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 117.752 0.251 . . . . 0.0 111.619 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -64.23 -37.26 86.84 Favored 'General case' 0 CA--C 1.501 -0.935 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.595 179.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.14 -44.0 86.62 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.993 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 178.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.3 mmtt -62.94 -43.08 99.76 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -67.59 -34.12 76.38 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.73 0.3 . . . . 0.0 111.02 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.84 -15.29 63.52 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 29.7 mt -111.46 12.17 21.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.526 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -58.04 141.4 50.05 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 121.96 0.886 . . . . 0.0 109.562 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 70.7 t -65.42 -36.29 77.33 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 CA-C-N 113.86 -1.518 . . . . 0.0 107.808 174.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -74.92 -29.47 60.97 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.127 -1.851 . . . . 0.0 112.238 -173.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 10.2 t -165.98 79.54 1.14 Allowed Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.589 -175.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -73.07 142.5 34.52 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 115.082 -2.812 . . . . 0.0 112.163 176.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.4 t0 -137.13 100.34 4.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.451 0.643 . . . . 0.0 110.383 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -55.5 -46.01 78.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -32.61 68.91 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-O 121.974 0.892 . . . . 0.0 109.933 -176.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -70.41 -40.55 73.8 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.269 -1.332 . . . . 0.0 108.633 -176.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -50.31 65.57 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 175.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.7 mt -56.82 -42.83 80.3 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -65.52 -37.89 88.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.585 0.707 . . . . 0.0 111.655 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -69.77 -46.88 64.83 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.622 0.725 . . . . 0.0 109.694 178.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.92 -49.34 71.53 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.873 177.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -59.32 -36.58 75.91 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.8 -44.59 61.32 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.4 -34.79 72.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.059 0.457 . . . . 0.0 110.459 -178.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.46 -16.48 65.27 Favored Glycine 0 C--O 1.24 0.491 0 N-CA-C 115.359 0.904 . . . . 0.0 115.359 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.4 t -113.01 -12.19 13.26 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.413 0.607 . . . . 0.0 110.633 -179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -67.64 149.19 50.38 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -77.28 84.51 3.73 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-O 122.537 1.16 . . . . 0.0 108.979 177.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.9 m -98.73 47.59 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 CA-C-O 122.96 1.362 . . . . 0.0 108.194 -178.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.0 t -66.21 173.43 3.16 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 -179.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.8 m -49.33 -33.65 13.87 Favored 'General case' 0 C--O 1.211 -0.949 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -174.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -55.35 -45.44 76.47 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.202 -0.311 . . . . 0.0 111.771 177.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.1 mp -83.76 -42.52 17.4 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -37.32 79.11 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -175.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -66.78 -32.89 74.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.477 0.18 . . . . 0.0 111.401 -179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -88.87 -6.44 57.32 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.843 179.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -129.89 44.35 2.98 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -178.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 32.3 p -64.88 -24.76 67.63 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.84 -33.26 75.59 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 122.399 1.095 . . . . 0.0 112.317 178.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 91.5 t -67.69 -43.18 86.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.4 t -64.28 -37.45 79.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.91 -34.5 78.1 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.642 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 87.4 m -76.59 -39.64 51.98 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 51.9 mt -58.62 -34.79 71.55 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.1 0.476 . . . . 0.0 110.926 179.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -64.65 -29.18 70.18 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.912 -0.493 . . . . 0.0 111.32 175.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -73.05 -44.75 60.27 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 122.283 -0.261 . . . . 0.0 111.654 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -78.43 -20.57 13.27 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.905 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 -176.362 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.403 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.4 OUTLIER -62.19 -17.41 58.04 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 177.165 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -118.72 19.31 13.21 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.174 0.59 . . . . 0.0 112.128 176.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -63.8 117.68 7.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.06 0.457 . . . . 0.0 112.211 -177.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -75.97 -31.47 59.03 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.11 -41.73 97.14 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -173.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -133.21 118.27 18.42 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -178.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -58.8 -45.7 89.27 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.362 178.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -56.07 -41.75 75.59 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -176.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 68.6 t -56.57 -44.94 81.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.658 0 O-C-N 121.87 -0.519 . . . . 0.0 109.813 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.7 ttp -64.07 -43.89 94.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 119.167 -0.444 . . . . 0.0 109.846 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.89 -47.39 77.98 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.326 -0.55 . . . . 0.0 112.085 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -70.11 -37.96 75.5 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 119.089 -1.045 . . . . 0.0 111.253 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.54 -40.65 87.93 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.41 -49.23 72.35 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.543 179.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.36 -43.23 88.3 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 55.2 t -70.32 -49.98 49.87 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.041 0 C-N-CA 122.924 0.49 . . . . 0.0 111.318 -177.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -55.44 -45.82 76.81 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -178.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 17.6 m -66.18 -35.18 79.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.515 0.674 . . . . 0.0 111.029 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 13.1 mtt85 -60.82 -30.32 70.01 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.993 -0.442 . . . . 0.0 109.952 174.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 8.3 mt -76.55 -34.48 58.5 Favored 'General case' 0 C--O 1.208 -1.119 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 -176.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -28.19 69.22 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.587 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 25.2 m . . . . . 0 C--N 1.316 -0.877 0 CA-C-N 114.67 -1.15 . . . . 0.0 111.946 177.754 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 7.3 m . . . . . 0 C--O 1.223 -0.322 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . 0.47 HG12 ' H ' ' A' ' 472' ' ' GLU . 0.1 OUTLIER -53.06 -54.21 18.23 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.137 0 CA-C-O 121.967 0.889 . . . . 0.0 112.134 -179.627 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . 0.47 ' H ' HG12 ' A' ' 471' ' ' VAL . 1.6 pt-20 -54.24 -34.24 60.24 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 113.744 -1.571 . . . . 0.0 113.423 178.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -69.85 -43.8 71.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 122.531 1.157 . . . . 0.0 108.167 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -70.06 -32.77 71.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.564 -177.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.5 tt -56.99 -35.66 69.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.447 178.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -58.5 -40.75 83.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.523 0.601 . . . . 0.0 109.92 178.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -66.85 -54.89 17.86 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 110.334 -0.247 . . . . 0.0 110.334 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -43.31 90.98 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 14.5 t-160 -57.31 -44.05 83.78 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.9 m -63.95 -38.5 91.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.485 0.18 . . . . 0.0 111.485 -179.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -63.3 -38.65 91.98 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.28 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.9 mt -58.22 -43.95 86.86 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -62.85 -44.74 95.32 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -178.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -66.36 -31.8 72.8 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.023 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.2 -18.39 65.23 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.897 0.702 . . . . 0.0 112.897 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 20.9 mt -106.84 12.14 29.29 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -177.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -54.72 130.15 39.52 Favored 'General case' 0 C--O 1.208 -1.119 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 178.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 55.8 t -63.5 -42.2 95.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 122.056 0.931 . . . . 0.0 109.471 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -67.6 -30.86 70.56 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 113.979 -1.464 . . . . 0.0 112.975 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 13.8 t -160.08 77.55 2.73 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.002 -175.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.61 149.23 34.01 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 117.123 -1.451 . . . . 0.0 112.383 179.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -137.21 97.77 3.57 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.857 0.836 . . . . 0.0 110.078 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -58.22 -46.36 88.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -179.212 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -59.74 -31.38 69.58 Favored 'General case' 0 CA--C 1.504 -0.811 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -177.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -69.08 -41.6 77.32 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.53 -47.89 77.12 Favored 'General case' 0 C--O 1.21 -1.021 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 175.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 84.6 mt -57.68 -44.06 85.52 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 118.045 0.384 . . . . 0.0 111.346 -176.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -63.07 -40.88 99.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.735 0.779 . . . . 0.0 110.901 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.14 -46.65 73.44 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.762 0.791 . . . . 0.0 109.529 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -51.16 68.91 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.337 178.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -61.44 -35.66 78.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -175.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.26 -43.25 64.6 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 118.775 -1.17 . . . . 0.0 108.473 177.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -33.31 67.6 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.359 0.599 . . . . 0.0 109.895 178.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.62 -17.68 69.21 Favored Glycine 0 C--O 1.238 0.379 0 N-CA-C 114.833 0.693 . . . . 0.0 114.833 179.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.3 t -110.5 -14.83 14.03 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 117.714 0.757 . . . . 0.0 110.402 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.4 mt -66.51 149.28 50.68 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.008 -0.433 . . . . 0.0 110.211 179.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -78.76 84.4 4.83 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-O 122.324 1.059 . . . . 0.0 111.916 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 17.5 m -106.93 76.9 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 CA-C-O 126.897 3.237 . . . . 0.0 106.514 176.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.3 t -88.46 171.59 9.99 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 110.235 -3.166 . . . . 0.0 103.677 172.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.26 -34.61 15.6 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.49 -41.51 73.13 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 3.8 mp -88.74 -39.65 12.72 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.822 0 CA-C-O 122.483 1.135 . . . . 0.0 108.912 -178.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 31.1 mt -60.78 -39.65 89.65 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.139 -174.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -63.44 -34.82 78.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -89.95 -8.06 52.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.24 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -125.92 37.83 4.27 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.428 0.632 . . . . 0.0 110.711 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 3.6 p -61.1 -28.11 68.85 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -178.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.57 -30.46 71.57 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.426 0.631 . . . . 0.0 112.136 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 34.0 t -74.24 -42.94 50.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.7 t -61.94 -37.75 79.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.86 -37.76 88.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.734 177.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 95.6 m -71.23 -39.31 71.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 70.0 mt -59.67 -35.75 75.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.199 0.523 . . . . 0.0 110.362 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -65.2 -29.09 69.87 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.947 -0.471 . . . . 0.0 111.254 175.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -72.18 -45.62 59.65 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 122.098 -0.376 . . . . 0.0 111.349 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 17.1 pt -78.79 -18.1 13.3 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.864 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -176.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.455 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.79 -15.93 59.94 Favored 'General case' 0 C--O 1.212 -0.899 0 O-C-N 121.965 -0.459 . . . . 0.0 111.503 176.287 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -118.72 17.94 13.47 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 122.774 0.429 . . . . 0.0 111.241 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -63.02 123.65 19.11 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.667 0.387 . . . . 0.0 110.207 -178.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -92.4 -21.92 19.94 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 -175.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.89 -41.61 91.31 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.265 0.555 . . . . 0.0 110.589 -177.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -130.26 115.55 17.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.025 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.6 tptt -55.76 -47.95 76.13 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.222 177.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -54.99 -42.81 72.95 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -175.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.7 t -56.68 -45.08 82.57 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 O-C-N 122.016 -0.428 . . . . 0.0 109.887 177.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.4 ttp -65.04 -43.79 91.19 Favored 'General case' 0 CA--C 1.51 -0.59 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.56 -48.6 76.78 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 44.0 tptt -71.0 -38.36 72.66 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.282 -178.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.52 -39.96 85.58 Favored 'General case' 0 CA--C 1.501 -0.926 0 CA-C-O 121.625 0.726 . . . . 0.0 109.044 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.455 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.89 -49.04 76.4 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.535 -1.211 . . . . 0.0 113.052 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.81 -41.35 91.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 51.2 t -70.45 -51.99 33.13 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.021 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.676 -177.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -54.59 -45.05 73.51 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.633 0.254 . . . . 0.0 110.317 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 20.5 m -65.93 -36.03 82.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.886 0.374 . . . . 0.0 111.248 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -59.37 -30.74 68.62 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.038 -0.413 . . . . 0.0 110.26 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 6.3 mt -76.63 -32.81 58.26 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 -176.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.71 -30.22 71.35 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.67 179.46 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 36.2 m . . . . . 0 C--N 1.316 -0.878 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.706 176.872 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.3 m . . . . . 0 C--O 1.225 -0.21 0 CA-C-O 121.054 0.454 . . . . 0.0 111.798 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 44.0 t -54.8 -46.9 75.04 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.24 -34.35 76.34 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -178.454 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -67.91 -41.2 83.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.579 1.181 . . . . 0.0 108.184 179.698 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -72.9 -35.31 67.06 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.569 -177.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 3.8 tt -57.92 -36.66 72.8 Favored 'General case' 0 C--O 1.211 -0.933 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.361 178.464 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -57.32 -42.42 81.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.835 0.743 . . . . 0.0 110.124 177.909 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -67.44 -54.33 21.23 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.645 178.118 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -44.85 88.62 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -178.465 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -57.79 -44.5 86.31 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -179.89 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.2 m -62.84 -39.3 93.94 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.623 0.231 . . . . 0.0 111.623 -179.03 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -63.98 -37.53 87.77 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.396 178.507 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.4 mt -58.99 -43.53 89.08 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 178.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -64.01 -44.06 93.76 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 122.082 -0.386 . . . . 0.0 112.003 -178.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -65.83 -32.8 74.52 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.75 -178.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.89 -16.67 64.19 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 179.224 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 35.2 mt -110.51 12.21 22.91 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -177.224 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 50.0 mttt -55.26 132.65 48.32 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.255 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.9 t -64.17 -41.71 93.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 122.343 1.068 . . . . 0.0 108.484 176.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -68.14 -29.75 68.71 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 113.574 -1.648 . . . . 0.0 113.281 -178.417 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 10.8 t -160.69 75.99 2.65 Favored Pre-proline 0 N--CA 1.469 0.513 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -175.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.36 145.87 30.75 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 117.203 -1.398 . . . . 0.0 113.206 178.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -137.32 100.66 4.3 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.286 0.565 . . . . 0.0 111.092 178.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -56.66 -45.36 82.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -179.341 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 10.9 pttt -59.33 -32.53 70.17 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 121.89 0.852 . . . . 0.0 109.605 -176.919 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -70.39 -40.8 73.73 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.417 -1.265 . . . . 0.0 108.816 -176.473 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.81 -48.5 71.5 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 175.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.8 mt -56.93 -43.39 81.44 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -176.724 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -65.42 -37.9 88.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.488 0.661 . . . . 0.0 111.745 179.608 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -69.33 -46.67 66.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.721 0.772 . . . . 0.0 109.682 178.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -49.39 72.75 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.396 178.938 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -61.46 -34.66 75.83 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -175.238 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -45.71 60.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 176.731 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.93 -33.51 68.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.465 0.65 . . . . 0.0 109.868 -178.691 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.93 -17.87 68.05 Favored Glycine 0 C--O 1.236 0.251 0 CA-C-O 119.206 -0.775 . . . . 0.0 114.852 179.423 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.7 t -112.53 -6.23 13.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.345 1.073 . . . . 0.0 110.894 -179.733 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.0 mt -72.49 150.16 43.5 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.05 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -78.84 84.46 4.89 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-O 122.671 1.224 . . . . 0.0 109.213 178.145 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.1 m -98.63 50.72 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-O 123.536 1.636 . . . . 0.0 109.115 -177.379 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 3.7 t -64.51 167.83 6.62 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 -179.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.7 m -49.25 -32.16 10.16 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -176.185 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -55.38 -44.7 76.31 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 178.28 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.0 mp -85.97 -43.46 16.46 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-O 121.961 0.886 . . . . 0.0 108.887 179.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.13 -39.91 79.91 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -175.182 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -72.7 -28.51 62.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.346 -176.767 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -88.99 -8.25 54.45 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.862 176.709 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -125.1 40.97 3.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.631 0.729 . . . . 0.0 111.735 -179.066 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 10.7 p -62.75 -24.48 67.72 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -179.103 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.62 -30.86 71.92 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.45 0.643 . . . . 0.0 112.037 177.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 22.6 t -71.87 -41.34 69.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.89 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 29.9 t -63.22 -37.98 80.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.681 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.93 -32.59 74.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.653 177.737 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.4 m -79.49 -40.22 30.24 Favored 'General case' 0 C--O 1.217 -0.632 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 38.7 mt -57.61 -35.41 70.42 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.114 0.483 . . . . 0.0 111.039 178.57 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -63.97 -29.05 70.24 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.07 -0.394 . . . . 0.0 111.533 175.175 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -74.13 -45.42 48.98 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.272 -0.268 . . . . 0.0 111.547 178.655 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -77.53 -21.23 14.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.932 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 -176.427 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.422 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -61.56 -18.87 61.12 Favored 'General case' 0 C--O 1.211 -0.959 0 O-C-N 121.961 -0.462 . . . . 0.0 111.658 176.056 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.75 19.44 13.15 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.154 0.582 . . . . 0.0 111.965 177.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -59.97 123.32 16.72 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.136 0.493 . . . . 0.0 111.629 -177.805 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -81.79 -28.46 33.18 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -176.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -69.17 -38.81 78.9 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -174.721 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -135.05 121.38 20.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.768 0.318 . . . . 0.0 110.765 -177.937 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.7 tptt -64.17 -40.32 95.87 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 178.221 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -46.97 73.88 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 123.341 0.656 . . . . 0.0 111.467 -176.525 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.0 t -58.73 -44.75 90.74 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.904 178.331 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -62.11 -44.2 97.16 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.97 -47.45 77.53 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.419 -0.512 . . . . 0.0 112.229 179.814 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -70.18 -38.21 75.34 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 118.408 -1.317 . . . . 0.0 111.285 -178.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.4 -39.73 84.34 Favored 'General case' 0 C--O 1.213 -0.832 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.365 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.422 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.91 -48.93 72.4 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.813 -1.085 . . . . 0.0 113.036 178.756 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -41.62 89.55 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.84 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.9 t -70.52 -50.33 46.08 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.013 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.937 -178.276 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -55.49 -44.74 76.81 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 -178.211 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.1 m -66.63 -35.57 80.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.263 0.554 . . . . 0.0 111.131 179.184 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 15.5 mtt85 -61.2 -29.43 69.81 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.879 -0.513 . . . . 0.0 109.99 175.217 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 8.8 mt -76.6 -36.03 57.76 Favored 'General case' 0 C--O 1.205 -1.268 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -177.555 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -30.1 70.24 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.588 178.931 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.4 m . . . . . 0 C--N 1.318 -0.801 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.108 178.483 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 C--O 1.225 -0.186 0 CA-C-O 121.027 0.441 . . . . 0.0 111.86 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.0 t -56.09 -47.93 79.74 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.929 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -179.749 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.94 -34.26 78.0 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -178.57 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -66.49 -43.59 84.98 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.024 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 19.7 mttt -69.37 -33.75 73.53 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.368 -178.02 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -56.71 -38.88 72.93 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.607 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.98 -40.22 69.84 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.992 -178.862 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -67.02 -55.06 16.0 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 176.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -46.14 90.63 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -176.712 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -61.45 -39.5 91.05 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.644 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 65.2 m -65.11 -41.17 95.17 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.556 179.164 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.13 -42.64 99.56 Favored 'General case' 0 CA--C 1.501 -0.934 0 C-N-CA 120.976 -0.289 . . . . 0.0 111.19 178.388 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -54.65 -46.64 73.16 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.269 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.683 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 43.6 mtpt -67.81 -38.85 83.81 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -177.425 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -67.32 -32.92 74.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.895 0.379 . . . . 0.0 110.198 178.099 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.0 -19.68 66.12 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 178.955 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 25.4 mt -105.22 12.16 32.21 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.386 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 29.4 mtpt -55.66 130.38 42.92 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.564 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 44.9 t -63.6 -40.51 89.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 122.395 1.093 . . . . 0.0 108.931 177.992 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -30.44 71.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.568 -1.651 . . . . 0.0 113.016 -178.24 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 2.7 p -163.08 79.66 1.68 Allowed Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.343 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.04 146.28 51.9 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 116.938 -1.575 . . . . 0.0 112.265 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -137.22 92.65 2.73 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.513 0.673 . . . . 0.0 109.921 -175.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -58.9 -45.0 92.06 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.798 0 N-CA-C 113.391 0.885 . . . . 0.0 113.391 -177.229 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -57.12 -31.9 65.78 Favored 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -178.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -71.03 -41.47 70.81 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.675 -177.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -63.92 -48.61 75.9 Favored 'General case' 0 C--O 1.211 -0.942 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 176.7 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 81.2 mt -57.99 -44.19 87.01 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 117.863 0.301 . . . . 0.0 111.619 -176.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.16 -39.07 91.4 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.622 0.725 . . . . 0.0 110.735 178.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.82 -49.33 62.83 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.357 0.598 . . . . 0.0 109.796 178.816 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -45.43 83.24 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.52 178.282 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -65.35 -33.31 75.66 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 121.243 -0.91 . . . . 0.0 112.504 -176.848 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -67.8 -49.37 62.71 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 105.307 -2.108 . . . . 0.0 105.307 175.395 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -30.63 33.53 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.54 0.686 . . . . 0.0 111.119 -177.64 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -62.97 -28.36 71.88 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 114.894 0.718 . . . . 0.0 114.894 178.163 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 8.0 t -100.86 -26.36 13.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 117.745 0.773 . . . . 0.0 110.808 -179.342 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.0 mp -55.46 136.01 50.04 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 176.362 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -78.81 84.37 4.87 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-O 122.975 1.369 . . . . 0.0 110.416 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.4 m -95.7 48.5 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.325 0 CA-C-O 122.963 1.363 . . . . 0.0 108.734 -178.988 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 8.9 t -66.92 171.64 5.21 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 -178.219 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.23 -30.74 7.52 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -174.369 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -55.48 -46.55 76.87 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.391 -0.193 . . . . 0.0 111.519 177.052 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -87.12 -41.05 14.42 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 CA-C-O 121.511 0.672 . . . . 0.0 109.695 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.7 -36.18 76.0 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -174.894 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -65.4 -32.27 73.81 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.755 0.788 . . . . 0.0 111.722 -178.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -95.76 -0.33 51.49 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.801 -179.229 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -133.01 42.59 3.04 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.568 0.699 . . . . 0.0 111.613 179.175 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.2 p -64.14 -27.21 68.93 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -179.122 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -65.04 -24.43 67.48 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.654 0.74 . . . . 0.0 111.938 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 55.4 t -70.55 -43.53 77.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 179.173 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 28.8 t -64.21 -36.17 76.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.238 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.26 -38.27 88.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.813 177.325 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.4 m -76.08 -38.6 56.84 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 118.874 0.761 . . . . 0.0 109.861 -179.551 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 49.5 mt -58.15 -35.19 71.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.02 0.438 . . . . 0.0 111.226 178.639 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -64.46 -29.18 70.23 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.993 -0.442 . . . . 0.0 111.465 175.129 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -73.04 -46.31 52.54 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 117.767 0.258 . . . . 0.0 111.423 178.845 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -77.21 -20.52 14.3 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -176.106 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -62.44 -15.82 51.63 Favored 'General case' 0 C--O 1.212 -0.885 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 177.259 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 11.6 ptp85 -118.69 19.34 13.23 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.031 0.533 . . . . 0.0 111.458 175.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -64.07 105.69 0.92 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -175.72 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -70.09 -30.14 67.29 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -176.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.74 -27.5 66.85 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -174.637 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -147.69 113.74 5.82 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.096 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 41.8 tptt -56.71 -45.46 81.87 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.531 -178.294 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -56.48 -40.68 75.32 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.987 0.422 . . . . 0.0 112.003 -175.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -56.84 -45.1 83.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 177.384 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -64.84 -43.41 93.14 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 119.192 -0.432 . . . . 0.0 110.241 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.48 -48.17 76.2 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.409 -0.517 . . . . 0.0 112.005 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 31.4 tptt -68.62 -39.48 80.78 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.071 -178.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.63 -40.82 84.46 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-O 121.306 0.574 . . . . 0.0 109.518 177.827 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.5 -48.27 75.78 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.247 -0.888 . . . . 0.0 113.296 179.433 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -42.24 93.67 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.1 t -70.65 -50.09 47.09 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.8 -178.579 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -54.79 -45.46 74.33 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.733 0.301 . . . . 0.0 110.193 -177.351 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.6 m -66.82 -33.97 76.77 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.397 0.617 . . . . 0.0 111.312 179.916 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 13.1 mtt85 -61.35 -29.81 70.13 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 121.796 -0.565 . . . . 0.0 109.96 174.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 9.0 mt -76.52 -34.01 58.58 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -175.208 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . 0.449 ' HA ' ' HZ2' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -63.29 -27.87 69.63 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.961 178.08 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 C--N 1.316 -0.891 0 CA-C-N 114.607 -1.179 . . . . 0.0 112.075 177.505 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 121.006 0.431 . . . . 0.0 111.777 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 56.0 t -54.61 -47.18 72.71 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.792 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.681 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.07 -33.78 76.86 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -178.53 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.11 -41.74 85.72 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.97 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -72.43 -32.73 66.55 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.863 -177.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -57.42 -39.17 75.64 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.306 -179.541 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -53.76 -38.84 64.82 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.969 -178.878 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -70.42 -55.38 9.19 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.444 176.424 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.9 -45.89 82.31 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -176.397 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 17.9 t-160 -62.02 -38.79 90.0 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.477 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 52.0 m -65.39 -41.31 93.81 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.357 178.696 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -63.81 -42.41 97.68 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 117.938 0.336 . . . . 0.0 111.255 178.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.52 -46.74 71.73 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 177.329 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 50.1 mtpt -68.14 -38.63 82.39 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.163 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -66.58 -32.68 74.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 177.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.78 -19.41 65.88 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 178.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 21.6 mt -104.11 12.1 34.36 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -56.47 129.44 40.73 Favored 'General case' 0 C--O 1.208 -1.114 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 178.126 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 57.0 t -62.41 -39.84 85.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 122.44 1.114 . . . . 0.0 108.242 177.229 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.36 -28.75 69.5 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 113.272 -1.786 . . . . 0.0 113.165 -179.506 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 95.9 p -163.03 76.68 1.87 Allowed Pre-proline 0 C--O 1.241 0.627 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.017 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.82 144.97 49.78 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 114.701 -3.066 . . . . 0.0 111.895 179.469 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -137.21 91.53 2.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.755 0.788 . . . . 0.0 110.228 -174.851 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -57.29 -45.65 85.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -177.636 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.72 -30.47 68.84 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -178.0 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -71.01 -41.64 70.65 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -178.501 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.23 -48.31 76.32 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.458 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 94.0 mt -57.64 -42.55 83.65 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 117.627 0.194 . . . . 0.0 111.464 -177.343 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -64.8 -39.1 93.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.3 0.572 . . . . 0.0 111.25 178.382 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -65.82 -48.67 70.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 177.995 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -44.57 89.62 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.505 178.822 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.27 -33.18 75.22 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 119.086 0.857 . . . . 0.0 111.544 -177.085 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -50.85 37.52 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 106.074 -1.825 . . . . 0.0 106.074 175.065 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.27 -30.72 18.74 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.211 0.529 . . . . 0.0 112.308 -177.479 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.64 -28.03 73.21 Favored Glycine 0 C--O 1.24 0.501 0 N-CA-C 114.91 0.724 . . . . 0.0 114.91 177.608 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 9.0 t -100.36 -25.94 14.05 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.322 0.561 . . . . 0.0 110.67 -177.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.0 mp -56.11 137.11 52.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 O-C-N 121.789 -0.569 . . . . 0.0 112.389 174.825 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -78.97 80.23 5.33 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 122.588 1.185 . . . . 0.0 109.795 -179.422 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 30.9 m -93.33 49.76 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 CA-C-O 123.248 1.499 . . . . 0.0 108.081 -179.731 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.6 t -66.96 174.95 2.72 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 113.859 -1.518 . . . . 0.0 107.122 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 21.0 m -49.29 -36.16 20.05 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -173.577 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -53.72 -44.54 69.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 178.42 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.57 -40.29 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 -179.33 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -39.81 81.89 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -176.261 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -68.89 -31.09 69.76 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.757 -0.202 . . . . 0.0 111.358 -178.375 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -90.04 -2.38 58.11 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 122.235 -0.291 . . . . 0.0 111.328 177.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -129.91 46.51 2.64 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.698 0.761 . . . . 0.0 111.802 179.046 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.2 p -64.6 -28.83 69.89 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 121.713 -0.617 . . . . 0.0 112.307 -179.29 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -65.41 -28.56 69.34 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.393 0.616 . . . . 0.0 111.715 177.851 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 59.5 t -68.9 -44.52 81.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.782 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 34.4 t -62.56 -36.36 74.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.211 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.6 -40.1 95.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 119.345 -0.36 . . . . 0.0 110.7 177.309 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 93.6 m -72.77 -39.71 66.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 118.704 0.684 . . . . 0.0 110.532 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 68.9 mt -57.76 -35.02 70.19 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.903 0.382 . . . . 0.0 111.133 178.828 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -65.41 -29.05 69.71 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.691 -0.631 . . . . 0.0 111.527 175.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -73.05 -46.03 54.09 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.022 0.439 . . . . 0.0 110.798 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 15.2 pt -77.39 -21.44 14.19 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 -175.843 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.457 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -62.49 -18.86 62.81 Favored 'General case' 0 C--O 1.212 -0.888 0 O-C-N 121.94 -0.475 . . . . 0.0 111.422 175.89 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.77 18.98 13.27 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 122.846 0.458 . . . . 0.0 111.101 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -63.04 119.95 10.47 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 122.612 0.365 . . . . 0.0 110.69 -178.479 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -88.45 -23.29 23.31 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 115.437 1.643 . . . . 0.0 115.437 -175.598 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.01 -41.22 91.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.245 0.545 . . . . 0.0 110.993 -177.641 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -130.8 112.64 13.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.91 -179.048 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -56.78 -43.65 81.06 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.889 179.086 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -55.79 -41.86 74.72 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -176.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.2 t -58.19 -43.33 85.45 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.092 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -64.17 -44.03 93.32 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 179.786 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -63.56 -48.91 75.52 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.958 -179.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -70.54 -39.04 74.23 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 118.717 -1.193 . . . . 0.0 111.132 -177.516 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.43 -39.56 83.93 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 121.355 0.598 . . . . 0.0 109.789 178.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.457 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.58 -46.2 83.74 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.28 -0.873 . . . . 0.0 113.172 178.745 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -40.42 90.67 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.006 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 55.6 t -70.68 -53.62 21.45 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.359 -178.793 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -53.94 -44.94 71.09 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 122.293 0.237 . . . . 0.0 110.734 -175.027 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 28.0 m -64.2 -38.79 92.33 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 123.203 0.601 . . . . 0.0 111.125 179.136 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 40.6 mtt85 -61.91 -30.65 71.04 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 121.748 -0.595 . . . . 0.0 110.909 176.923 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 5.8 mt -75.6 -31.73 60.05 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 -177.149 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -36.57 78.72 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.974 176.014 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 CA--C 1.539 0.534 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 177.02 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 N--CA 1.461 0.121 0 CA-C-O 121.088 0.471 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.2 t -55.43 -46.17 78.53 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.047 0 O-C-N 122.212 -0.305 . . . . 0.0 111.543 179.095 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.69 -35.25 80.43 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -177.529 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.56 -42.08 87.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.84 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -69.22 -38.12 78.38 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 121.546 0.688 . . . . 0.0 109.503 -179.154 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 4.5 tt -57.73 -35.58 70.88 Favored 'General case' 0 C--O 1.209 -1.045 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.727 179.424 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -57.58 -41.31 80.89 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 119.366 0.984 . . . . 0.0 110.402 178.066 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -67.39 -53.22 31.19 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.721 178.427 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -45.22 88.81 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.892 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -58.17 -44.8 88.15 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.1 m -62.69 -39.07 92.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 -179.125 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -64.11 -37.62 88.12 Favored 'General case' 0 CA--C 1.505 -0.764 0 C-N-CA 120.516 -0.473 . . . . 0.0 110.49 178.346 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.4 mt -59.09 -43.39 89.1 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.954 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 178.845 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -63.04 -45.32 92.81 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 122.127 -0.358 . . . . 0.0 111.855 -179.485 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -65.71 -33.24 75.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.734 0.302 . . . . 0.0 111.121 -178.524 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.15 -15.99 64.05 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 179.37 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 36.0 mt -111.87 12.1 20.82 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -177.914 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt -54.23 129.48 35.22 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 177.434 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.39 -40.33 83.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 122.73 1.253 . . . . 0.0 107.893 177.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.84 -24.63 64.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 112.959 -1.928 . . . . 0.0 113.348 179.944 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 7.1 m -159.58 71.74 3.3 Favored Pre-proline 0 N--CA 1.475 0.788 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -176.778 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -71.49 139.82 35.2 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 114.142 -3.438 . . . . 0.0 112.006 179.144 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -137.14 95.85 3.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.529 0.681 . . . . 0.0 111.583 -177.649 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -55.12 -48.88 75.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -176.871 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 19.8 pttm -58.61 -32.55 69.11 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-O 122.533 1.159 . . . . 0.0 110.503 -175.566 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -67.86 -42.17 81.75 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.194 -178.144 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.8 -48.34 74.79 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.733 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 75.5 mt -56.76 -43.19 80.55 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -176.125 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -64.64 -38.77 92.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.639 0.733 . . . . 0.0 111.95 179.384 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -69.85 -44.87 69.0 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.468 0.652 . . . . 0.0 109.551 179.333 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.05 -49.8 72.73 Favored 'General case' 0 N--CA 1.428 -1.564 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.463 177.224 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -62.4 -34.86 77.56 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -175.376 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -67.8 -48.22 66.88 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 176.367 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -32.21 66.46 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.291 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.6 -15.66 66.64 Favored Glycine 0 N--CA 1.453 -0.222 0 CA-C-O 119.104 -0.831 . . . . 0.0 114.382 179.129 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.5 t -114.54 -13.72 12.16 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.482 1.141 . . . . 0.0 110.968 179.518 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.0 mt -67.29 148.25 51.93 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.818 -0.551 . . . . 0.0 110.558 179.472 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -77.83 84.41 4.14 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 122.738 1.256 . . . . 0.0 109.936 178.261 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.8 m -98.35 50.11 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-O 123.228 1.489 . . . . 0.0 109.138 -177.597 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.1 t -68.58 171.89 6.97 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 106.567 -1.642 . . . . 0.0 106.567 -179.195 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.28 -33.49 13.14 Favored 'General case' 0 C--O 1.218 -0.596 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -174.109 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -54.19 -44.39 71.51 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 111.441 0.163 . . . . 0.0 111.441 178.378 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.5 mp -88.52 -43.13 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-O 121.337 0.589 . . . . 0.0 110.088 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -40.37 84.26 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -175.527 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -71.14 -28.64 64.43 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.136 -176.35 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -89.76 -5.55 56.85 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 122.332 -0.23 . . . . 0.0 111.169 176.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -127.44 42.55 3.3 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.854 0.835 . . . . 0.0 112.505 179.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 17.8 p -63.86 -24.01 67.58 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -179.264 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.54 -32.27 73.85 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.314 1.054 . . . . 0.0 112.213 178.293 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.3 t -69.6 -42.58 80.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 179.118 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 48.5 t -63.2 -37.47 79.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.079 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.41 -33.13 74.88 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.655 178.029 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.7 m -79.29 -39.38 33.08 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.904 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 40.7 mt -57.43 -34.7 69.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.985 0.421 . . . . 0.0 111.431 178.22 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -63.87 -29.2 70.41 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.781 -0.574 . . . . 0.0 111.568 175.157 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -74.77 -43.34 55.33 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.603 0.239 . . . . 0.0 111.611 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -78.78 -21.82 12.93 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.952 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -177.373 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -60.65 -17.91 50.3 Favored 'General case' 0 C--O 1.211 -0.924 0 O-C-N 122.032 -0.417 . . . . 0.0 112.091 176.357 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -118.71 19.35 13.21 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.053 0.541 . . . . 0.0 111.269 178.005 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -65.7 115.34 5.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.167 0.508 . . . . 0.0 111.46 -176.968 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -82.91 -23.6 33.46 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 -176.488 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.54 -40.33 92.78 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.972 -177.093 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -133.22 113.23 12.43 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.87 -178.773 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.1 tptt -56.05 -44.66 79.06 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.565 178.728 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -55.32 -43.15 74.65 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -176.731 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 76.0 t -57.91 -43.93 85.56 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 177.477 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -62.97 -44.69 95.36 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 119.333 -0.365 . . . . 0.0 110.04 179.414 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.91 -47.51 77.5 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.5 tptt -69.33 -39.24 78.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.115 -1.034 . . . . 0.0 111.28 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.92 85.94 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.263 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.421 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.73 -48.82 75.47 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.774 -1.103 . . . . 0.0 113.142 178.863 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -43.32 92.6 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.841 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 78.8 t -68.94 -50.55 53.06 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.877 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.162 -178.416 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -55.03 -43.86 74.09 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.611 0.243 . . . . 0.0 110.446 -177.692 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 16.5 m -67.57 -35.82 79.74 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 122.641 0.377 . . . . 0.0 111.123 179.265 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.52 -31.85 69.77 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 176.182 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 5.5 mt -75.08 -36.73 61.72 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -176.327 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -56.45 -37.68 70.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.629 179.429 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 13.8 m . . . . . 0 C--N 1.322 -0.598 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 178.421 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.4 m . . . . . 0 C--O 1.224 -0.263 0 CA-C-O 120.998 0.427 . . . . 0.0 111.784 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 32.7 t -53.89 -47.6 63.92 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 O-C-N 122.007 -0.433 . . . . 0.0 111.97 179.399 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.2 pt-20 -62.31 -33.68 75.13 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.428 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -67.28 -40.8 86.16 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -179.565 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -74.21 -35.58 63.92 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.409 -178.034 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 3.7 tt -58.63 -37.2 75.39 Favored 'General case' 0 C--O 1.206 -1.197 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.237 178.369 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -59.07 -40.85 86.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 119.036 0.835 . . . . 0.0 110.61 178.422 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -64.82 -53.13 51.7 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.789 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -44.57 93.89 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.079 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.4 t-160 -57.9 -44.79 86.99 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -178.898 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.7 m -62.77 -39.63 94.8 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.181 0.301 . . . . 0.0 111.622 -179.325 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -64.41 -37.25 86.86 Favored 'General case' 0 CA--C 1.504 -0.81 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.625 178.337 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.8 mt -59.14 -43.47 89.48 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.031 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 178.872 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.7 mmtt -63.68 -46.02 87.43 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.37 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -64.81 -33.04 75.05 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 120.8 0.333 . . . . 0.0 111.16 -178.246 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.59 -17.55 64.67 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 179.958 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.2 mt -111.89 12.05 20.8 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -177.091 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -66.76 133.38 50.02 Favored 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 179.932 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 40.4 t -56.89 -39.14 63.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-O 122.079 0.942 . . . . 0.0 111.326 -177.246 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -63.02 -30.24 71.44 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 113.978 -1.465 . . . . 0.0 113.381 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 2.2 m -164.53 78.62 1.43 Allowed Pre-proline 0 N--CA 1.479 0.986 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.399 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.96 147.52 61.75 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 115.732 -2.379 . . . . 0.0 112.339 177.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -137.3 99.57 4.01 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.672 0.748 . . . . 0.0 110.118 -179.386 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.22 -47.26 84.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.355 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.94 -32.62 67.97 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 121.99 0.9 . . . . 0.0 109.989 -176.74 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -69.52 -41.37 76.09 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.268 -1.333 . . . . 0.0 108.933 -176.543 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.57 -49.81 67.48 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 176.096 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 81.2 mt -56.45 -43.07 79.16 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.286 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.35 -38.27 90.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.64 0.733 . . . . 0.0 112.07 -179.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -72.1 -44.81 62.64 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.722 -0.612 . . . . 0.0 109.642 178.449 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -48.09 72.55 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.542 177.205 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -62.55 -35.76 80.48 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -176.17 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -67.84 -48.97 64.69 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.395 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.66 -33.63 64.25 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.88 -179.526 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.71 -17.77 69.49 Favored Glycine 0 C--O 1.236 0.276 0 N-CA-C 115.165 0.826 . . . . 0.0 115.165 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.9 t -111.08 -12.77 14.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.064 0.932 . . . . 0.0 110.484 -179.584 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 5.2 mt -67.71 148.15 51.69 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.979 -0.451 . . . . 0.0 110.462 -179.884 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -78.59 84.46 4.71 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-O 122.841 1.305 . . . . 0.0 109.078 177.655 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 30.3 m -99.97 48.37 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 CA-C-O 123.087 1.422 . . . . 0.0 108.477 -177.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.4 t -67.06 172.45 4.55 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 -179.602 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 24.1 m -49.23 -32.19 10.14 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -174.419 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -54.48 -44.95 73.08 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 178.169 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.4 mp -88.68 -42.6 14.79 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 CA-C-O 121.261 0.553 . . . . 0.0 109.656 179.388 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -40.07 83.16 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 -175.196 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -70.53 -28.95 65.33 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.192 -176.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -90.54 -4.25 57.03 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 122.364 -0.21 . . . . 0.0 111.171 177.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -128.24 43.02 3.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.674 0.75 . . . . 0.0 112.361 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.7 p -63.44 -24.34 67.79 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -178.833 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.64 -30.61 71.34 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.527 0.679 . . . . 0.0 112.158 178.077 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 42.7 t -71.18 -41.55 75.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 107.262 -1.385 . . . . 0.0 107.262 178.402 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 38.1 t -62.99 -37.67 79.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.616 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.08 -34.52 78.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.447 177.7 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.7 m -77.1 -39.76 48.39 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.668 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 47.0 mt -58.36 -35.52 72.08 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.261 0.553 . . . . 0.0 110.933 178.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.56 -29.08 70.1 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.998 -0.439 . . . . 0.0 111.343 175.246 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -72.91 -45.33 58.73 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 117.839 0.29 . . . . 0.0 111.472 178.391 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -77.66 -21.68 13.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -176.215 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.424 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.2 OUTLIER -61.19 -18.32 57.65 Favored 'General case' 0 C--O 1.211 -0.958 0 O-C-N 122.132 -0.355 . . . . 0.0 111.895 176.452 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -118.74 19.45 13.16 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.025 0.53 . . . . 0.0 112.042 176.537 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -60.96 118.18 6.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.236 0.541 . . . . 0.0 112.24 -177.263 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -74.04 -33.18 63.64 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 -176.672 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.01 -41.9 85.86 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -172.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -131.91 117.2 18.16 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 122.314 -0.241 . . . . 0.0 110.867 -177.811 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.4 tptt -57.7 -46.63 84.08 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.517 178.165 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -55.64 -42.66 75.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -176.383 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 72.2 t -56.73 -44.47 81.6 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.521 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 177.242 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.9 ttp -64.29 -43.86 93.45 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 119.151 -0.452 . . . . 0.0 110.036 179.435 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -64.7 -47.32 78.78 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.377 -0.529 . . . . 0.0 112.092 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -69.65 -39.14 77.25 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 119.148 -1.021 . . . . 0.0 111.104 -179.138 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.1 -39.92 83.71 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.414 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.88 -49.54 70.08 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.922 -1.036 . . . . 0.0 113.18 179.081 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -42.6 91.25 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.983 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.8 t -70.6 -50.09 47.42 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.464 -177.93 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -55.35 -45.11 76.46 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -177.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.6 m -66.75 -34.77 78.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.399 0.618 . . . . 0.0 111.186 179.55 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 12.3 mtt85 -60.71 -29.77 69.54 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.864 -0.522 . . . . 0.0 109.967 175.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 8.8 mt -76.52 -35.3 58.39 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -176.134 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . 0.414 ' HA ' ' HZ2' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -62.81 -28.93 70.34 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.03 178.902 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 22.1 m . . . . . 0 C--N 1.317 -0.835 0 CA-C-N 114.718 -1.128 . . . . 0.0 111.905 178.385 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.5 m . . . . . 0 C--O 1.225 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 111.263 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 56.7 t -57.37 -46.41 85.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.022 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.432 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -65.49 -34.16 77.63 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.572 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -65.24 -42.86 92.92 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 177.393 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -70.05 -34.61 73.45 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.041 -179.201 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -57.55 -40.43 78.88 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.356 -178.552 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -55.01 -40.09 69.77 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.579 -179.213 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 53.3 tttt -67.94 -57.77 5.64 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.503 -0.184 . . . . 0.0 110.503 176.744 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -45.52 89.02 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -176.126 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -60.0 -42.28 93.92 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -179.325 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 61.8 m -62.64 -39.67 94.6 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.998 -179.218 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -63.72 -37.85 88.89 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.077 178.431 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -60.08 -42.53 90.24 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.022 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.368 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -64.81 -45.12 87.6 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 122.182 -0.324 . . . . 0.0 111.568 -179.452 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -66.2 -30.44 70.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.192 -178.185 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.73 -18.19 64.81 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 178.604 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 35.2 mt -107.66 12.21 27.76 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -177.985 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -55.23 135.87 49.25 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-O 121.697 0.761 . . . . 0.0 109.914 178.124 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 13.0 m -73.49 -21.45 18.63 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.149 178.877 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.58 -31.18 47.11 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 113.798 -1.546 . . . . 0.0 111.251 -178.873 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 43.5 t -168.8 83.41 0.69 Allowed Pre-proline 0 C--O 1.238 0.483 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.912 -175.831 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.35 146.45 50.66 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 115.447 -2.569 . . . . 0.0 111.964 178.014 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -137.18 100.12 4.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.857 0.837 . . . . 0.0 111.419 -178.839 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -58.85 -44.2 90.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.959 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -60.65 -31.82 71.02 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -177.849 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -71.53 -41.81 68.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.1 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -48.61 75.83 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.407 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 71.4 mt -56.87 -43.88 81.66 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -176.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -65.35 -38.72 90.95 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.322 0.582 . . . . 0.0 111.326 -179.658 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.24 -47.13 71.7 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.425 0.631 . . . . 0.0 109.463 178.631 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.09 -42.2 80.27 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.054 178.085 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -62.8 -37.93 88.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 119.094 0.861 . . . . 0.0 112.579 -177.942 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -70.93 -44.09 66.87 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.91 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -32.92 66.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.522 0.677 . . . . 0.0 110.738 179.164 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.53 -16.97 66.13 Favored Glycine 0 C--O 1.239 0.433 0 CA-C-O 119.165 -0.797 . . . . 0.0 114.749 -179.84 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.5 t -113.74 -15.37 12.46 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.15 0.975 . . . . 0.0 111.227 -179.766 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.0 mt -64.94 145.24 56.58 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.98 -0.45 . . . . 0.0 110.813 179.734 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -79.62 84.29 5.49 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 122.531 1.158 . . . . 0.0 109.653 178.168 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.0 m -96.44 48.18 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-O 123.214 1.483 . . . . 0.0 108.21 -178.705 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.7 t -68.16 172.99 5.06 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 -178.296 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.6 m -49.29 -31.65 9.41 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -173.643 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -55.43 -44.59 76.44 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 177.015 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.4 mp -88.66 -42.18 14.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.566 0 CA-C-O 121.72 0.772 . . . . 0.0 109.1 -179.279 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -40.5 78.71 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -175.591 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -69.71 -31.3 69.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.15 -177.455 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -89.29 -5.14 57.81 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.233 178.31 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -128.94 45.03 2.86 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.43 0.633 . . . . 0.0 112.19 -179.652 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 25.2 p -65.08 -26.76 68.37 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -179.375 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -63.39 -27.25 69.17 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.918 0.866 . . . . 0.0 111.992 177.799 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 55.0 t -70.65 -45.69 72.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 179.549 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.4 -36.99 78.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 179.052 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.4 -36.36 82.08 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.861 177.42 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 61.4 m -76.26 -40.54 51.63 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 118.182 0.446 . . . . 0.0 110.457 179.445 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 61.4 mt -57.97 -35.12 70.71 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.051 0.453 . . . . 0.0 111.087 178.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -63.86 -29.0 70.23 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.9 -0.5 . . . . 0.0 111.452 175.733 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -73.19 -46.46 50.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.787 0.327 . . . . 0.0 111.31 178.81 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 7.7 pt -77.12 -21.18 14.4 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -175.983 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.439 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.28 -14.7 52.52 Favored 'General case' 0 C--O 1.213 -0.842 0 O-C-N 121.746 -0.596 . . . . 0.0 112.282 175.786 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -118.86 17.78 13.37 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 122.48 0.312 . . . . 0.0 111.233 175.69 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -62.88 126.16 26.4 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.957 0.408 . . . . 0.0 110.856 -177.071 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -92.43 -24.95 18.68 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -176.437 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.82 -39.81 94.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.155 0.502 . . . . 0.0 110.965 -176.963 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -133.64 121.09 21.51 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.055 -179.405 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -60.26 -44.02 95.65 Favored 'General case' 0 C--O 1.211 -0.963 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.875 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.69 -43.98 76.92 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -175.401 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.6 t -58.39 -44.65 89.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.136 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.8 ttp -64.94 -43.29 93.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.106 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.43 -48.9 75.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 179.353 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 40.2 tptt -71.66 -37.72 70.76 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 118.493 -1.283 . . . . 0.0 111.19 -177.518 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.2 -40.73 82.33 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-O 121.785 0.802 . . . . 0.0 108.952 178.363 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.439 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.75 -50.81 69.6 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.219 -1.355 . . . . 0.0 113.84 178.756 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.47 -43.67 89.01 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 -179.381 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.21 -52.62 41.01 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -177.134 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -53.98 -44.05 70.48 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.598 0.359 . . . . 0.0 110.551 -177.416 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 50.8 m -64.07 -38.52 91.37 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 123.844 0.858 . . . . 0.0 111.681 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -64.41 -28.5 69.72 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 121.552 -0.717 . . . . 0.0 110.781 176.734 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 7.2 mt -74.39 -35.62 63.49 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.027 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -57.72 -39.48 77.37 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.165 177.413 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--N 1.325 -0.477 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 178.947 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 7.1 m . . . . . 0 C--O 1.221 -0.441 0 CA-C-O 120.756 0.312 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -54.79 -45.83 74.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 O-C-N 121.894 -0.504 . . . . 0.0 111.578 179.516 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.48 -31.58 72.34 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.021 -178.854 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -73.5 -42.14 62.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 122.138 0.97 . . . . 0.0 108.405 179.384 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -70.33 -32.71 70.56 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.379 -177.628 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -55.05 -40.21 70.04 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.358 178.842 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -54.23 -40.6 67.85 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.686 -178.268 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -69.54 -53.2 20.14 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.314 177.75 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -46.86 86.56 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -178.742 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -60.25 -43.67 95.91 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -179.465 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 69.0 m -60.24 -38.71 84.28 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 118.01 0.368 . . . . 0.0 111.124 -179.83 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -65.71 -36.34 83.34 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 120.159 -0.617 . . . . 0.0 110.978 177.549 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 89.1 mt -61.46 -43.12 96.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 178.696 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -62.18 -45.87 91.48 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 179.825 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -66.5 -34.23 77.45 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.747 0.308 . . . . 0.0 111.207 -178.368 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.35 -18.95 65.13 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 179.677 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.8 mt -108.2 12.15 26.86 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.573 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 8.5 mttm -56.82 131.6 49.87 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 176.869 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 14.5 m -72.7 -20.39 19.3 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.634 -179.329 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.7 -30.74 41.13 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 113.779 -1.555 . . . . 0.0 110.921 -178.951 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 25.0 t -166.27 85.8 0.92 Allowed Pre-proline 0 C--O 1.239 0.512 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.418 -177.977 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.81 149.56 48.21 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 117.314 -1.324 . . . . 0.0 112.415 178.477 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -137.29 93.39 2.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.589 0.709 . . . . 0.0 110.183 -177.246 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -58.4 -47.34 88.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 -177.438 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 26.5 pttt -58.77 -31.4 68.34 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-O 121.696 0.76 . . . . 0.0 110.347 -176.38 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.0 ttm-85 -68.81 -43.33 75.81 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.227 -178.673 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.24 -48.81 76.68 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.556 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.9 mt -57.48 -42.79 83.34 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -176.762 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -65.53 -38.58 90.07 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.54 0.686 . . . . 0.0 111.495 179.163 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.69 -47.07 70.48 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.034 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -45.58 82.46 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.206 178.859 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -64.75 -34.63 78.78 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -176.486 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -44.11 66.42 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 176.282 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.79 -35.6 66.47 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.28 0.562 . . . . 0.0 110.898 179.429 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.46 -18.65 69.97 Favored Glycine 0 C--O 1.239 0.448 0 N-CA-C 114.762 0.665 . . . . 0.0 114.762 -179.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 12.7 t -109.31 -12.4 14.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.917 0.858 . . . . 0.0 110.581 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -68.78 146.25 53.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.163 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -80.35 80.58 6.76 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-O 122.508 1.147 . . . . 0.0 109.031 178.144 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 29.3 m -94.3 48.17 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 123.071 1.415 . . . . 0.0 107.576 179.754 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.68 173.62 3.35 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.709 -177.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 34.3 m -48.46 -35.33 12.73 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.517 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -55.52 -44.34 76.58 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.267 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -87.62 -38.71 12.25 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.397 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -179.41 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.21 -37.74 81.2 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -176.749 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -66.27 -33.73 76.4 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.567 0.222 . . . . 0.0 111.426 -179.553 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -89.35 -3.29 58.52 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 121.076 -0.25 . . . . 0.0 111.316 179.172 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -128.12 43.42 3.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.875 0.845 . . . . 0.0 112.398 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -64.17 -28.56 69.84 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 121.722 -0.611 . . . . 0.0 112.466 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -70.53 -24.26 62.78 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.501 0.667 . . . . 0.0 112.034 179.176 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 86.7 t -70.87 -43.82 76.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 106.152 -1.796 . . . . 0.0 106.152 177.302 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 49.5 t -62.53 -35.62 70.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 178.244 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.99 -35.93 81.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 119.042 -0.504 . . . . 0.0 111.645 177.318 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.5 m -77.06 -39.17 50.87 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.165 0.893 . . . . 0.0 108.734 179.32 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 34.9 mt -57.5 -35.01 69.69 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.813 0.34 . . . . 0.0 111.664 179.019 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -63.3 -29.12 70.5 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.878 -0.513 . . . . 0.0 111.392 175.623 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -76.49 -46.24 27.6 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.657 0.265 . . . . 0.0 111.708 -179.422 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.1 pt -74.77 -23.57 17.78 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.932 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -176.929 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.449 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 1.7 mtm180 -59.94 -20.65 58.67 Favored 'General case' 0 C--O 1.214 -0.788 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 176.152 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -119.51 19.41 12.66 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.976 0.51 . . . . 0.0 111.48 178.854 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -62.03 117.91 6.59 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 121.063 0.458 . . . . 0.0 111.355 -177.564 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -79.49 -26.59 41.59 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -176.475 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.14 -40.93 86.84 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.692 -0.403 . . . . 0.0 112.081 -175.354 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -131.55 117.0 18.16 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -178.464 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -59.05 -43.62 91.7 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.617 179.039 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -57.79 -42.24 83.76 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.062 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -57.53 -43.12 82.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 O-C-N 121.809 -0.557 . . . . 0.0 109.542 177.454 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -43.03 94.36 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 178.559 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -63.87 -49.28 73.39 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.121 0.263 . . . . 0.0 110.476 -178.336 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -70.88 -40.63 72.13 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.958 -178.222 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.14 -38.77 80.47 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.14 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.449 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.79 -50.17 70.05 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 177.757 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.68 -42.15 83.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 77.0 t -70.44 -52.06 32.59 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.859 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.135 -178.618 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -54.48 -44.47 72.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.641 0.258 . . . . 0.0 110.412 -177.171 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 24.8 m -65.25 -38.43 90.33 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 122.909 0.483 . . . . 0.0 111.022 179.358 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 44.1 mtt180 -59.99 -30.71 69.31 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 121.838 -0.539 . . . . 0.0 110.752 176.573 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 3.8 mt -76.24 -30.88 58.08 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 -176.782 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.11 -37.95 89.23 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.899 177.575 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.7 m . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 177.982 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 C--O 1.222 -0.389 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 22.4 t -53.0 -47.04 54.47 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.122 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 178.841 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.74 -34.19 77.33 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.585 -177.252 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -68.76 -40.5 79.71 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 122.464 1.126 . . . . 0.0 108.526 179.42 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -73.34 -34.86 65.88 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.1 -177.731 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 4.5 tt -58.42 -36.14 73.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.054 179.408 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -54.18 -43.13 70.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 118.456 0.571 . . . . 0.0 109.862 178.325 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -67.82 -56.32 9.6 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.556 178.372 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -44.99 81.16 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.333 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -58.52 -43.56 89.21 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 179.166 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.5 m -64.74 -37.85 88.99 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 179.495 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -63.38 -38.14 90.01 Favored 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.05 178.307 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.11 -44.25 87.03 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.535 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.4 mmtt -62.52 -46.3 89.04 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -179.514 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -64.6 -33.59 76.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.871 0.367 . . . . 0.0 111.159 -178.243 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.84 -18.21 65.18 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 179.371 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 26.1 mt -108.07 12.15 27.08 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.112 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -56.12 127.81 32.43 Favored 'General case' 0 CA--C 1.493 -1.219 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 176.527 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 29.6 m -70.25 -20.48 22.87 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.211 178.536 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -80.97 -27.41 36.0 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.155 -1.384 . . . . 0.0 111.091 177.864 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 4.2 m -160.81 75.62 2.63 Favored Pre-proline 0 N--CA 1.473 0.676 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -74.35 143.35 31.31 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 113.523 -3.851 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -137.25 98.19 3.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.788 0.804 . . . . 0.0 109.734 -178.65 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.44 -45.51 93.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.509 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -59.55 -31.05 69.06 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 -178.362 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -70.37 -41.29 73.3 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.762 -0.775 . . . . 0.0 108.96 -178.1 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.03 -48.35 76.66 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 175.889 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 96.7 mt -57.27 -43.18 82.87 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -176.719 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -64.58 -39.03 93.0 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.532 0.682 . . . . 0.0 111.3 178.677 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -65.74 -48.5 71.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.648 0.737 . . . . 0.0 109.695 178.599 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.86 -48.27 80.3 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.997 178.641 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -62.94 -33.07 74.57 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 119.847 -0.741 . . . . 0.0 112.803 -175.631 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.35 -48.65 40.18 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.44 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -30.67 42.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.801 0.81 . . . . 0.0 110.155 -178.849 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -63.85 -23.6 67.57 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 115.846 1.098 . . . . 0.0 115.846 176.821 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 9.0 t -104.88 -26.48 12.2 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 117.883 0.841 . . . . 0.0 110.367 178.766 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.2 mp -57.0 140.5 48.82 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 176.058 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -76.99 84.41 3.51 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 122.339 1.066 . . . . 0.0 110.692 -178.914 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 16.6 m -103.42 68.95 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 CA-C-O 126.794 3.188 . . . . 0.0 105.489 178.039 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.0 t -80.41 173.73 12.31 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 109.892 -3.322 . . . . 0.0 105.204 172.636 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.2 m -49.36 -36.73 22.4 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -175.365 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -54.29 -43.77 71.35 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -179.017 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.0 mp -88.56 -38.98 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.801 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 -178.03 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 4.8 mt -61.61 -39.4 91.12 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -175.886 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -68.82 -31.0 69.67 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.193 -0.203 . . . . 0.0 110.644 -177.861 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -87.27 -7.04 58.28 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 121.122 -0.231 . . . . 0.0 111.073 176.781 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -129.6 45.77 2.75 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.545 0.688 . . . . 0.0 112.11 179.194 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -63.89 -25.95 68.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.877 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.07 -29.03 69.3 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.846 0.831 . . . . 0.0 112.337 178.556 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 65.0 t -71.08 -45.01 74.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 178.553 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 57.2 t -61.0 -38.1 78.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.149 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.25 -38.95 92.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.88 177.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 95.3 m -71.94 -38.69 69.79 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 118.371 0.532 . . . . 0.0 109.961 -178.613 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 63.3 mt -58.63 -34.89 71.69 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.116 0.484 . . . . 0.0 111.461 179.422 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -67.26 -29.13 68.67 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 121.613 -0.679 . . . . 0.0 111.012 176.27 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -71.52 -42.1 68.37 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.725 0.298 . . . . 0.0 111.151 179.861 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 6.0 pt -78.65 -23.28 13.12 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.266 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.54 ' HD2' ' HA ' ' A' ' 540' ' ' ALA . 7.4 mtp180 -64.69 -13.31 53.84 Favored 'General case' 0 C--O 1.217 -0.638 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 175.655 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.89 18.47 13.25 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.947 0.499 . . . . 0.0 111.544 175.07 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -66.47 118.07 9.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 112.044 -177.677 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -81.81 -26.64 34.18 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -177.573 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.54 -29.87 68.54 Favored 'General case' 0 C--O 1.219 -0.512 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -175.151 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -144.69 118.88 9.48 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.415 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -61.76 -46.58 88.95 Favored 'General case' 0 C--O 1.213 -0.86 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.452 -178.626 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -56.04 -38.96 71.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.17 0.509 . . . . 0.0 112.109 -175.175 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.8 t -55.96 -45.31 80.07 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 O-C-N 122.076 -0.39 . . . . 0.0 110.111 177.539 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -68.06 -40.78 82.69 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.754 178.432 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.09 -47.98 80.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 119.303 0.956 . . . . 0.0 111.567 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.7 tptt -72.18 -37.91 69.21 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 119.076 -1.049 . . . . 0.0 111.378 -178.741 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.08 -38.06 78.56 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.254 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.54 ' HA ' ' HD2' ' A' ' 527' ' ' ARG . . . -66.63 -49.97 64.52 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.358 179.275 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -42.48 83.59 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.886 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 75.3 t -70.59 -53.45 22.37 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.262 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.965 -177.887 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 69.9 t80 -53.81 -46.97 71.26 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.184 0.516 . . . . 0.0 110.312 -176.011 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 27.8 m -60.07 -38.15 82.01 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.38 0.672 . . . . 0.0 112.343 178.286 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -65.21 -27.41 68.66 Favored 'General case' 0 C--N 1.32 -0.709 0 O-C-N 121.419 -0.801 . . . . 0.0 111.785 176.749 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 9.7 mt -75.59 -35.77 60.49 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -174.651 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -33.95 73.55 Favored 'General case' 0 C--O 1.205 -1.273 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.67 176.704 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 45.3 t . . . . . 0 C--N 1.319 -0.72 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.315 175.019 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.1 m . . . . . 0 C--O 1.224 -0.271 0 CA-C-O 121.109 0.481 . . . . 0.0 112.073 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.6 t -54.21 -44.19 63.64 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.38 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -66.92 -33.18 75.02 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 120.762 0.315 . . . . 0.0 111.721 -178.274 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.18 -39.98 82.38 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.675 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -73.72 -32.18 63.76 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.935 -177.242 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -54.58 -38.96 67.33 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.253 178.833 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -53.18 -38.71 63.06 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 121.321 -0.151 . . . . 0.0 111.264 -178.693 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -67.83 -57.67 5.89 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.568 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.88 -46.22 90.0 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -174.526 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -58.92 -43.16 91.08 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -179.501 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 67.0 m -63.28 -40.4 97.28 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 117.869 0.304 . . . . 0.0 111.213 -178.935 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -63.57 -37.52 87.65 Favored 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 120.671 -0.411 . . . . 0.0 111.149 178.862 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 94.3 mt -59.9 -44.06 93.52 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.989 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.168 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 49.2 mmtt -62.67 -44.67 95.66 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 122.153 -0.342 . . . . 0.0 111.919 -179.746 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -65.13 -33.88 77.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.781 0.324 . . . . 0.0 111.073 -178.189 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.89 -16.55 64.39 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 179.249 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 38.4 mt -111.08 12.24 21.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.868 -177.459 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -55.44 129.4 38.56 Favored 'General case' 0 C--O 1.21 -1.011 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 176.665 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.9 t -62.62 -39.75 85.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 122.16 0.981 . . . . 0.0 108.446 178.507 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.12 -28.07 64.04 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.066 -1.425 . . . . 0.0 113.414 -178.021 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.1 t -159.48 76.38 3.06 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -177.593 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -75.33 146.6 31.68 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 117.495 -1.203 . . . . 0.0 113.812 179.516 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -137.37 101.64 4.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.31 0.576 . . . . 0.0 111.397 178.575 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -56.58 -46.17 82.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -179.429 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 15.0 pttt -58.77 -32.2 69.06 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 121.857 0.837 . . . . 0.0 109.791 -176.478 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -70.83 -40.48 72.41 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.391 -1.277 . . . . 0.0 108.888 -176.476 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.51 -49.7 68.02 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 175.624 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.6 mt -56.91 -43.1 81.04 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.256 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -66.01 -37.08 84.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.467 0.651 . . . . 0.0 111.625 179.997 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.84 -47.71 68.21 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.772 0.796 . . . . 0.0 109.316 177.702 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.71 -44.97 82.07 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.77 178.632 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -60.57 -36.8 79.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 119.036 0.835 . . . . 0.0 112.673 -177.165 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -73.77 -42.64 60.74 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 178.69 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.91 -34.29 71.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.164 0.507 . . . . 0.0 110.637 -179.436 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.1 -17.67 66.0 Favored Glycine 0 C--O 1.241 0.565 0 N-CA-C 114.848 0.699 . . . . 0.0 114.848 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.8 t -110.69 -14.7 13.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 117.699 0.75 . . . . 0.0 110.587 -179.131 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.2 mt -67.44 145.86 54.58 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.489 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -79.16 84.3 5.14 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 122.53 1.157 . . . . 0.0 109.797 178.37 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.8 m -96.8 48.5 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 CA-C-O 123.351 1.548 . . . . 0.0 108.126 -178.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.5 t -67.26 174.43 3.25 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 -179.436 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 13.1 m -49.23 -34.75 15.65 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -173.361 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -53.7 -44.06 69.47 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.73 0.271 . . . . 0.0 111.73 178.187 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.5 mp -88.48 -40.69 13.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.53 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -38.04 80.89 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -175.644 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -66.99 -32.61 73.96 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.559 -179.002 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -90.23 -4.3 57.29 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.347 -0.221 . . . . 0.0 111.088 178.813 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -128.58 45.91 2.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.777 0.799 . . . . 0.0 112.484 -179.355 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 29.0 p -66.06 -26.91 67.71 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.426 -0.796 . . . . 0.0 112.399 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.4 -28.26 66.93 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.596 1.189 . . . . 0.0 112.465 178.383 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 91.4 t -68.69 -44.78 82.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 178.968 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.79 -37.5 79.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 178.354 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.42 -34.32 76.54 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.046 177.806 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.8 m -78.53 -39.47 37.85 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 118.48 0.582 . . . . 0.0 109.676 -179.801 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 44.0 mt -57.7 -34.92 69.96 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.962 0.41 . . . . 0.0 111.407 178.591 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -63.73 -29.13 70.39 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.879 -0.513 . . . . 0.0 111.629 175.232 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -74.02 -42.59 60.1 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 122.098 -0.376 . . . . 0.0 111.977 -179.741 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -78.83 -21.64 12.88 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -178.406 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . 0.422 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -65.02 -11.21 36.52 Favored 'General case' 0 C--O 1.214 -0.78 0 O-C-N 121.97 -0.456 . . . . 0.0 112.097 175.554 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 41.0 ptt85 -122.13 19.44 10.74 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 122.998 0.519 . . . . 0.0 111.596 175.334 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -65.48 120.46 12.9 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -175.606 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -85.98 -27.92 24.56 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -177.434 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.86 -41.45 95.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.245 0.545 . . . . 0.0 111.616 -175.289 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -132.35 112.5 12.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.948 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . 0.454 ' HZ1' ' CD ' ' A' ' 537' ' ' GLU . 9.4 tmtt? -62.62 -33.57 75.28 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.272 -179.314 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -58.17 -41.98 85.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.521 0.676 . . . . 0.0 111.34 -179.969 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 94.3 t -60.27 -41.02 85.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 O-C-N 121.876 -0.515 . . . . 0.0 109.618 178.238 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 38.1 ttm -57.8 -47.38 82.73 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 120.814 0.34 . . . . 0.0 110.122 179.073 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . 0.454 ' CD ' ' HZ1' ' A' ' 533' ' ' LYS . 5.6 mm-40 -65.24 -48.38 73.51 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.035 -179.458 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -72.03 -37.81 69.68 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 118.627 -1.229 . . . . 0.0 111.147 -175.399 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.94 -38.66 83.06 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.01 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . 0.422 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -66.83 -48.97 67.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.861 -1.063 . . . . 0.0 113.709 179.425 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -41.83 88.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -179.705 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 63.3 t -70.6 -51.03 40.52 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.593 -178.689 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -55.08 -44.74 75.11 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.597 0.237 . . . . 0.0 110.486 -177.554 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 20.7 m -67.07 -35.55 80.08 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 123.019 0.528 . . . . 0.0 110.727 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 16.0 mtt85 -60.58 -29.3 69.1 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 121.807 -0.558 . . . . 0.0 110.157 175.606 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 9.4 mt -76.2 -34.44 59.28 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 -175.603 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . 0.483 ' HA ' ' HZ2' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -60.77 -31.5 70.85 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.061 178.205 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.6 m . . . . . 0 C--N 1.319 -0.73 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 176.908 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.5 m . . . . . 0 C--O 1.224 -0.268 0 CA-C-O 120.939 0.4 . . . . 0.0 111.274 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 49.9 t -54.38 -45.19 69.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.064 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 179.652 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.74 -34.13 77.59 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.796 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -68.0 -41.29 82.47 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 178.604 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -72.35 -32.61 66.63 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.219 -177.84 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -56.61 -38.85 72.63 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.186 178.846 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -53.42 -40.45 65.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 118.345 0.52 . . . . 0.0 110.654 -179.065 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 56.8 tttt -67.36 -56.68 8.7 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 176.856 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -45.91 89.89 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -176.119 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -60.37 -43.32 96.67 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -179.739 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 67.4 m -62.17 -40.47 96.13 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.644 -178.574 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -63.01 -38.72 92.33 Favored 'General case' 0 CA--C 1.508 -0.662 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.402 178.61 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -60.23 -43.57 93.64 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 179.472 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.41 -41.95 93.06 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.524 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -65.73 -34.33 77.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.801 0.334 . . . . 0.0 110.875 179.623 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.35 -17.13 64.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 179.398 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 25.8 mt -108.59 12.14 26.17 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -178.614 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 6.0 mtpt -54.88 130.97 43.25 Favored 'General case' 0 C--O 1.209 -1.068 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 177.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.0 t -63.75 -41.17 91.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 122.468 1.127 . . . . 0.0 108.129 177.507 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -28.95 68.23 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 113.465 -1.698 . . . . 0.0 113.632 -179.337 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.3 t -159.75 76.08 2.99 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.799 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -75.56 144.5 28.53 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 116.6 -1.8 . . . . 0.0 113.535 179.407 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -137.08 104.27 5.38 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.277 0.561 . . . . 0.0 111.099 179.477 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.04 -46.09 94.69 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.934 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -57.02 -32.67 66.39 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 120.96 0.41 . . . . 0.0 109.931 -177.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -70.12 -40.29 74.94 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -176.234 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.95 -49.04 71.91 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 176.007 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 74.9 mt -57.31 -44.1 83.85 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -175.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.62 -40.15 96.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.76 0.791 . . . . 0.0 110.336 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -68.91 -46.92 67.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.361 0.6 . . . . 0.0 110.49 179.39 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.88 -48.64 75.22 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.477 179.139 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -63.02 -35.62 80.83 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -175.483 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -69.98 -43.27 71.81 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 176.707 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -59.29 -34.74 72.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.343 0.592 . . . . 0.0 110.336 -179.338 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.17 -17.98 62.09 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-O 119.207 -0.774 . . . . 0.0 114.745 179.78 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.3 t -112.95 -7.7 13.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.149 0.975 . . . . 0.0 111.064 -179.449 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.5 mt -72.72 148.57 44.55 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.523 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -78.57 84.58 4.68 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 122.807 1.289 . . . . 0.0 109.985 178.388 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.8 m -97.07 46.83 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.325 0 CA-C-O 122.748 1.261 . . . . 0.0 108.939 -178.181 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.0 t -67.28 172.43 4.81 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -178.244 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 15.7 m -49.36 -32.15 10.78 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -173.949 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.36 -45.3 76.52 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 122.348 -0.22 . . . . 0.0 111.528 177.799 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.5 mp -86.86 -42.39 15.43 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.818 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.08 -40.13 80.3 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -175.715 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -69.55 -29.43 67.01 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.354 -177.654 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -90.53 -3.34 57.67 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 122.338 -0.227 . . . . 0.0 110.979 177.537 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -128.76 45.3 2.81 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.71 0.767 . . . . 0.0 112.388 179.382 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 22.3 p -64.66 -27.35 68.86 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.881 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.39 -24.59 65.7 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 122.1 0.952 . . . . 0.0 112.207 178.167 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.5 t -71.74 -45.98 63.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 178.363 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.82 -35.54 71.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.846 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -58.21 -46.1 86.46 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 176.46 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.7 m -71.2 -39.15 71.97 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.641 -175.331 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 72.7 mt -57.61 -35.47 70.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.884 0.373 . . . . 0.0 111.186 179.044 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -66.06 -29.12 69.41 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 121.789 -0.569 . . . . 0.0 112.382 176.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.92 -53.11 10.84 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.826 0.822 . . . . 0.0 110.419 179.633 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 22.6 pt -65.47 -24.64 35.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -179.419 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.28 -16.92 61.79 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 176.004 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.73 19.2 13.24 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.791 0.437 . . . . 0.0 111.111 177.072 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -65.72 120.86 13.75 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 123.201 0.6 . . . . 0.0 111.462 -179.027 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -91.5 -19.42 22.82 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -178.126 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -69.49 -22.81 63.58 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.129 -177.754 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.68 128.98 12.0 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.749 174.774 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -64.28 -49.5 71.59 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.222 -178.454 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -58.17 -38.36 76.49 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.251 0.548 . . . . 0.0 111.808 -173.839 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.95 -44.9 79.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 176.873 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.6 ttp -68.32 -43.26 77.97 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 119.256 -0.402 . . . . 0.0 110.362 179.431 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -64.36 -47.78 78.03 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.406 -0.518 . . . . 0.0 112.354 -179.411 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -69.82 -38.09 76.46 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.42 -178.3 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.2 -40.73 86.7 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-O 121.619 0.723 . . . . 0.0 109.287 178.133 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.61 73.87 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.524 -1.217 . . . . 0.0 112.638 -179.923 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -42.48 90.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.454 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.2 t -70.5 -51.11 40.34 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.994 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.414 -178.317 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -54.49 -45.09 73.15 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -177.781 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.9 m -66.19 -35.11 79.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.297 0.57 . . . . 0.0 111.262 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 23.1 mtt85 -61.65 -30.07 70.48 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.783 -0.573 . . . . 0.0 109.947 174.933 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 8.5 mt -76.68 -34.05 58.22 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -175.754 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -28.14 68.85 Favored 'General case' 0 C--O 1.217 -0.639 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.67 178.212 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.9 m . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 114.92 -1.037 . . . . 0.0 111.991 177.769 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -71.72 155.37 40.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 177.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 80.1 p -153.96 154.87 30.61 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 105.384 -2.08 . . . . 0.0 105.384 178.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -67.93 149.61 77.74 Favored 'Trans proline' 0 C--O 1.245 0.836 0 C-N-CA 116.627 -1.782 . . . . 0.0 113.189 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.2 m -69.52 167.0 17.69 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.615 -179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 53.7 t -56.18 -47.78 80.24 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.907 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.751 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -63.44 -34.18 77.18 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -67.16 -42.74 83.83 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 177.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 17.5 mttt -69.43 -35.48 75.72 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 121.727 0.775 . . . . 0.0 109.997 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.13 -37.42 71.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.879 -179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -54.46 -40.68 68.63 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.405 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -72.36 -54.06 10.52 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.131 177.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.47 -46.75 73.43 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 -177.258 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.4 t-160 -61.33 -41.06 96.39 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 52.5 m -64.06 -40.57 96.56 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.97 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -63.72 -43.09 97.59 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-N 118.153 0.433 . . . . 0.0 110.652 178.1 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.02 -46.89 66.02 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.19 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 177.568 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -67.01 -39.5 87.11 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -177.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -68.57 -28.07 66.63 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 122.157 -0.339 . . . . 0.0 110.755 177.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.69 -18.42 62.82 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.6 mt -105.99 12.08 30.89 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.874 -177.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 52.4 mttt -54.09 127.29 26.03 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.6 t -62.26 -42.11 94.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.932 0.872 . . . . 0.0 109.678 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.33 -30.66 69.68 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.205 -1.362 . . . . 0.0 112.943 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 14.2 t -155.31 75.9 5.17 Favored Pre-proline 0 C--O 1.244 0.769 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -175.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -74.95 146.65 33.13 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 117.394 -1.271 . . . . 0.0 112.72 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -137.28 100.76 4.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.331 0.586 . . . . 0.0 109.762 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.72 -46.13 96.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.7 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -58.09 -31.12 66.81 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.064 0.227 . . . . 0.0 110.447 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -69.28 -41.11 77.28 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.69 -49.04 69.99 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.498 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 83.4 mt -56.85 -44.18 81.91 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.07 -41.07 97.77 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.6 0.714 . . . . 0.0 110.824 179.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.93 -47.3 69.07 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.286 0.565 . . . . 0.0 109.767 179.789 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.29 -46.32 79.82 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.186 177.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -64.66 -35.36 80.79 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 119.032 0.833 . . . . 0.0 113.123 -176.171 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -68.88 -46.61 67.95 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 176.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.69 -33.23 68.15 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.427 0.632 . . . . 0.0 110.547 -179.417 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.76 -19.21 67.09 Favored Glycine 0 C--O 1.238 0.345 0 CA-C-O 119.312 -0.716 . . . . 0.0 114.543 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.7 t -109.98 -13.75 14.36 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.91 0.855 . . . . 0.0 110.237 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.0 mt -67.3 145.91 54.65 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.964 -0.46 . . . . 0.0 110.344 179.382 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -79.37 84.45 5.28 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-O 122.79 1.281 . . . . 0.0 109.809 178.501 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.8 m -95.69 46.49 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 CA-C-O 122.9 1.333 . . . . 0.0 108.433 -179.055 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.4 t -66.67 171.78 4.84 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 -177.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.1 m -49.26 -30.9 7.89 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -174.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -56.09 -46.58 78.99 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 175.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -86.72 -41.77 15.08 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.455 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.51 -39.69 77.05 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.84 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -68.12 -31.21 70.64 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.392 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -90.38 -4.44 57.06 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 122.172 -0.33 . . . . 0.0 111.331 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -127.94 41.11 3.56 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.276 0.56 . . . . 0.0 111.458 -179.291 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.2 p -63.64 -27.93 69.56 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 121.604 -0.685 . . . . 0.0 112.776 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.13 -26.41 68.18 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.617 0.722 . . . . 0.0 111.842 177.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 47.6 t -71.93 -43.15 68.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 44.9 t -62.71 -35.23 69.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 178.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.09 85.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 119.228 -0.415 . . . . 0.0 111.368 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.0 m -78.14 -37.91 44.96 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 118.991 0.814 . . . . 0.0 109.719 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 39.5 mt -57.97 -35.0 70.56 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.076 0.465 . . . . 0.0 111.178 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -64.56 -29.08 70.11 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.803 -0.561 . . . . 0.0 111.536 175.102 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -74.31 -41.62 60.83 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.2 pt -78.74 -23.14 13.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.103 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.214 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.4 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.2 OUTLIER -63.15 -13.07 32.64 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 176.26 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.7 ptt180 -119.14 16.35 13.23 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 122.822 0.449 . . . . 0.0 110.841 176.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -64.66 121.82 15.38 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.059 0.457 . . . . 0.0 112.103 -175.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -92.29 -25.62 18.5 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -177.375 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.02 -25.51 65.43 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.637 -177.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.86 121.22 9.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.915 0.388 . . . . 0.0 110.371 174.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -39.99 94.98 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.91 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -60.68 -40.95 94.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.614 0.721 . . . . 0.0 111.745 -176.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 59.4 t -56.01 -43.39 75.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.957 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.7 ttp -66.27 -40.73 90.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 122.066 0.146 . . . . 0.0 110.621 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.42 -48.41 70.12 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -69.7 -38.26 76.9 Favored 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 118.977 -1.089 . . . . 0.0 110.244 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.63 -39.87 81.75 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -67.2 -48.37 68.09 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -40.79 90.53 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 62.1 t -70.63 -53.1 23.73 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.3 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . 0.515 ' CE1' ' HD3' ' A' ' 547' ' ' LYS . 51.6 t80 -55.0 -41.74 71.65 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.181 0.515 . . . . 0.0 110.901 -177.213 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 544' ' ' THR . . . . . 0.458 ' HA ' ' HE3' ' A' ' 547' ' ' LYS . 30.0 m -65.27 -38.55 90.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.141 0.496 . . . . 0.0 111.197 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 -64.74 -27.05 68.64 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.177 177.015 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 11.9 mt -73.94 -37.8 64.45 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -176.724 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . 0.515 ' HD3' ' CE1' ' A' ' 543' ' ' TYR . 5.2 mtmp? -63.76 -24.73 67.88 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.273 178.114 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.8 m -81.67 -8.55 59.72 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.127 178.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 73.7 mtt85 -113.42 -15.79 12.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 122.512 0.325 . . . . 0.0 111.8 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -94.11 -158.74 33.74 Favored Glycine 0 N--CA 1.453 -0.226 0 CA-C-N 116.166 -0.47 . . . . 0.0 112.936 -176.62 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--O 1.256 1.402 0 N-CA-C 104.335 -2.469 . . . . 0.0 104.335 178.633 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.705 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -68.65 151.81 46.21 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 174.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 19.2 m 47.08 59.49 16.33 Favored Pre-proline 0 N--CA 1.477 0.877 0 O-C-N 123.675 0.609 . . . . 0.0 111.938 -175.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -71.78 152.79 58.82 Favored 'Trans proline' 0 C--N 1.348 0.552 0 N-CA-C 115.884 1.455 . . . . 0.0 115.884 -174.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.1 m -70.89 166.7 20.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.745 178.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 48.6 t -53.75 -49.25 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -179.432 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -65.92 -32.28 73.69 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.693 -178.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -67.47 -40.71 85.31 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 12.7 mtpt -72.32 -32.99 67.03 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.499 -176.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.7 -40.11 71.93 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.548 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -53.23 -39.85 64.11 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 121.245 -0.182 . . . . 0.0 110.895 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -71.97 -55.24 7.79 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.265 176.291 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -47.06 78.43 Favored 'General case' 0 C--O 1.218 -0.563 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -175.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -61.47 -39.88 92.49 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 59.1 m -64.92 -41.25 95.72 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.587 179.253 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -63.19 -43.17 98.94 Favored 'General case' 0 CA--C 1.506 -0.718 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.805 178.762 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.14 -47.62 66.76 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -67.36 -37.68 83.58 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -176.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -67.73 -31.64 71.71 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.55 -19.09 65.24 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 23.8 mt -103.06 12.19 36.27 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 38.6 mttt -55.57 128.52 34.93 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 72.2 t -61.43 -43.12 96.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.816 0.817 . . . . 0.0 109.66 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -74.23 -19.84 60.38 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.469 -1.242 . . . . 0.0 113.456 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 7.3 m -156.39 69.0 4.79 Favored Pre-proline 0 N--CA 1.47 0.574 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -176.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.58 145.11 29.16 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 114.267 -3.355 . . . . 0.0 112.573 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -137.33 96.76 3.33 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.892 0.853 . . . . 0.0 109.867 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -56.32 -46.43 81.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -178.931 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.35 -30.67 69.69 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -69.73 -40.43 76.22 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 -178.037 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.97 -49.1 71.61 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.814 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 87.5 mt -56.64 -43.06 79.89 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -64.39 -38.54 91.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.387 0.613 . . . . 0.0 111.425 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.03 -48.53 68.07 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 177.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.38 -43.73 79.5 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.207 178.55 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -65.59 -33.78 76.7 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 119.315 0.961 . . . . 0.0 112.912 -177.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.98 -46.58 64.89 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 175.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -34.36 65.98 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.44 0.638 . . . . 0.0 110.983 -179.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.92 -18.43 68.65 Favored Glycine 0 C--O 1.237 0.333 0 CA-C-O 119.235 -0.759 . . . . 0.0 114.883 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 15.1 t -110.29 -14.64 14.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 117.992 0.896 . . . . 0.0 110.354 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.5 mt -65.39 144.01 57.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.0 0.428 . . . . 0.0 110.728 179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -78.62 84.34 4.73 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 122.46 1.124 . . . . 0.0 109.192 177.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 29.5 m -97.13 46.77 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-O 123.11 1.433 . . . . 0.0 108.922 -178.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.6 t -67.34 172.93 4.34 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.3 m -49.11 -33.68 12.34 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -173.07 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -55.18 -43.06 73.98 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 178.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.1 mp -88.45 -41.76 14.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.54 -39.16 83.04 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.404 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -67.13 -32.46 73.6 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.682 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -88.99 -3.85 58.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.999 -0.28 . . . . 0.0 110.56 178.545 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -129.01 42.73 3.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.4 p -64.28 -28.16 69.53 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.499 -0.751 . . . . 0.0 112.248 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -67.51 -24.05 65.53 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.506 0.67 . . . . 0.0 111.952 177.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 60.8 t -71.97 -45.13 65.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 178.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 42.7 t -62.24 -35.51 69.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.77 94.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.175 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 98.6 m -74.41 -38.99 62.94 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 119.168 0.895 . . . . 0.0 110.407 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 63.5 mt -57.29 -35.15 69.44 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.998 0.428 . . . . 0.0 111.334 178.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -65.7 -29.23 69.74 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.769 -0.582 . . . . 0.0 111.762 175.8 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -73.02 -44.42 60.9 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.974 0.416 . . . . 0.0 110.877 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 17.3 pt -78.54 -21.94 13.16 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.784 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -176.023 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.404 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.6 OUTLIER -61.45 -18.36 58.58 Favored 'General case' 0 C--O 1.214 -0.803 0 O-C-N 121.741 -0.6 . . . . 0.0 111.968 175.402 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.75 19.42 13.16 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 122.897 0.479 . . . . 0.0 111.379 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -64.64 113.67 3.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.97 0.414 . . . . 0.0 112.01 -177.191 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -75.22 -30.0 60.44 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -176.761 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.25 95.77 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -174.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -131.21 110.83 11.42 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.11 -0.329 . . . . 0.0 110.11 -178.171 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 39.3 tptt -56.27 -43.85 79.19 Favored 'General case' 0 C--O 1.207 -1.139 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.211 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -55.49 -42.67 74.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.123 0.487 . . . . 0.0 112.172 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.1 t -57.09 -44.46 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -63.87 -44.24 93.68 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.59 -47.47 78.54 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.11 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 41.5 tptt -70.27 -38.95 75.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 118.488 -1.285 . . . . 0.0 110.715 -178.124 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.06 -40.94 86.72 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.368 0.604 . . . . 0.0 109.392 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.404 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.9 -48.73 77.7 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.081 -0.963 . . . . 0.0 113.503 179.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -41.76 89.68 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.2 t -70.51 -52.81 26.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.876 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.514 -177.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . 0.509 ' CE1' ' HD3' ' A' ' 547' ' ' LYS . 37.5 t80 -54.91 -42.51 72.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.343 0.592 . . . . 0.0 111.253 -177.386 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.5 m -66.95 -36.9 83.26 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.877 0.37 . . . . 0.0 110.447 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 10.7 mtt85 -63.69 -30.06 71.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.761 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 13.2 mt -71.7 -38.23 70.59 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -175.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . 0.509 ' HD3' ' CE1' ' A' ' 543' ' ' TYR . 4.2 mtmp? -61.08 -29.5 69.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.935 -1.029 . . . . 0.0 112.317 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 23.6 m -74.74 -17.46 60.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.582 176.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 73.5 mtt85 -100.45 -33.99 10.12 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -157.03 31.81 0.55 Allowed Glycine 0 C--O 1.226 -0.384 0 N-CA-C 116.251 1.26 . . . . 0.0 116.251 -177.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 N--CA 1.48 1.038 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -179.565 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -75.58 156.51 34.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.069 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 30.9 p -78.52 150.07 75.91 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 176.738 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.74 145.37 62.9 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 116.188 -2.075 . . . . 0.0 112.377 178.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 19.8 m -70.72 165.59 22.66 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.607 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 34.1 t -55.17 -46.85 77.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.019 0 O-C-N 122.114 -0.366 . . . . 0.0 110.719 178.364 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.4 pt-20 -61.26 -34.15 74.69 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.402 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -67.03 -40.93 87.31 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 122.378 1.085 . . . . 0.0 108.678 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -74.08 -34.8 64.13 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.35 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 4.2 tt -58.88 -36.82 75.28 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.244 177.787 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -57.58 -41.58 81.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 119.244 0.929 . . . . 0.0 109.908 178.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -68.07 -53.18 27.44 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.618 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -46.34 84.96 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -179.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -58.41 -44.71 89.13 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 -179.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.0 m -63.17 -38.59 91.77 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.087 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.57 -37.57 88.01 Favored 'General case' 0 CA--C 1.498 -1.03 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.75 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.7 mt -58.95 -42.26 85.51 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.053 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 22.4 mmtt -64.9 -45.36 86.27 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 120.864 0.364 . . . . 0.0 111.7 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -66.9 -28.51 68.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.414 -178.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.96 -17.81 63.32 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 122.722 0.409 . . . . 0.0 111.912 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.8 mt -109.63 12.14 24.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.605 -176.732 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -53.25 128.29 27.54 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.3 t -60.31 -42.36 90.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.825 0.822 . . . . 0.0 109.672 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -71.88 -24.87 61.74 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.378 -1.283 . . . . 0.0 113.168 -177.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 46.5 m -156.34 72.7 5.0 Favored Pre-proline 0 C--O 1.244 0.814 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -176.068 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.93 144.66 43.55 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 115.95 -2.234 . . . . 0.0 112.484 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -137.23 102.04 4.71 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.114 0.483 . . . . 0.0 109.874 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -61.08 -47.33 94.05 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.882 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -178.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -57.26 -31.16 65.29 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 123.118 0.261 . . . . 0.0 110.497 -178.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -69.38 -40.88 77.14 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.26 -49.56 69.12 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.479 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 70.2 mt -56.89 -44.13 82.01 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -176.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -61.45 -39.14 89.75 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.681 0.753 . . . . 0.0 111.749 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -72.18 -46.58 55.77 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.372 0.606 . . . . 0.0 109.831 178.235 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.62 -48.67 71.92 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.925 178.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -60.84 -35.99 77.97 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -175.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.13 -47.08 53.73 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.03 -34.48 68.23 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.335 0.588 . . . . 0.0 110.153 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.51 -14.53 64.78 Favored Glycine 0 C--O 1.236 0.224 0 N-CA-C 115.339 0.896 . . . . 0.0 115.339 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 15.1 t -111.97 -16.92 13.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 117.767 0.783 . . . . 0.0 110.493 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.6 mt -63.88 150.8 44.13 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.213 -0.304 . . . . 0.0 110.947 -178.544 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 38.2 tt0 -79.51 84.53 5.37 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-O 122.6 1.19 . . . . 0.0 109.188 178.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 30.0 m -101.04 48.21 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.279 0 CA-C-O 123.367 1.556 . . . . 0.0 108.029 -178.244 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 13.7 t -67.79 171.86 6.03 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.1 m -49.23 -31.0 7.89 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -173.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -55.45 -44.1 76.06 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 122.292 -0.255 . . . . 0.0 111.558 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -88.6 -42.36 14.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.543 0 CA-C-O 121.683 0.754 . . . . 0.0 109.275 179.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.11 -40.86 82.26 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -174.273 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -72.48 -28.74 63.09 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.399 -175.694 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -88.6 -9.16 53.16 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 122.198 -0.314 . . . . 0.0 110.762 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -125.53 39.71 3.9 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.486 0.66 . . . . 0.0 111.402 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -62.78 -23.87 67.44 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.67 -31.46 72.69 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.995 0.902 . . . . 0.0 112.365 178.046 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 60.2 t -70.26 -41.76 78.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 42.0 t -63.39 -37.71 80.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.2 -34.11 77.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.593 177.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 88.0 m -76.59 -39.39 52.72 Favored 'General case' 0 C--O 1.219 -0.509 0 O-C-N 122.172 -0.33 . . . . 0.0 110.414 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 57.9 mt -59.16 -35.0 72.76 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.215 0.531 . . . . 0.0 110.734 178.94 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -63.47 -29.14 70.47 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 122.007 -0.433 . . . . 0.0 111.159 175.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -73.82 -42.72 60.49 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.5 pt -78.77 -23.06 12.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -178.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.425 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.37 -13.96 34.9 Favored 'General case' 0 C--O 1.214 -0.791 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 177.039 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -118.59 15.83 13.69 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.094 0.558 . . . . 0.0 111.401 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -69.46 116.93 10.44 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 122.889 0.476 . . . . 0.0 111.409 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -92.35 -16.44 26.0 Favored 'General case' 0 C--O 1.217 -0.605 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -177.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -69.5 -22.23 63.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.472 -178.49 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -150.38 126.27 10.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.584 0.231 . . . . 0.0 110.654 174.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -63.06 -49.29 75.13 Favored 'General case' 0 C--O 1.21 -0.979 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.049 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -57.14 -39.31 74.94 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.259 0.552 . . . . 0.0 111.94 -174.229 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.88 -45.35 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 122.057 -0.402 . . . . 0.0 110.024 176.727 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.2 ttp -67.29 -44.0 80.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 119.407 -0.33 . . . . 0.0 110.2 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -64.04 -47.4 80.35 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -70.3 -37.99 74.88 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 119.245 -0.982 . . . . 0.0 110.954 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.56 -40.93 84.42 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-O 121.83 0.824 . . . . 0.0 108.813 178.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.425 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.78 -51.11 66.31 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.144 -1.389 . . . . 0.0 113.921 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -43.75 84.83 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.93 -52.16 37.24 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.93 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.449 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -54.56 -46.04 73.59 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.583 0.23 . . . . 0.0 110.534 -177.457 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 41.3 m -64.67 -36.56 84.67 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.639 0.776 . . . . 0.0 111.443 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -63.73 -27.84 69.48 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.649 -0.657 . . . . 0.0 110.704 175.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 11.5 mt -74.47 -36.23 63.29 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.261 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . 0.448 ' HA ' ' HZ1' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -60.75 -30.62 70.12 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.459 178.74 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.2 m -80.1 -15.73 56.51 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.888 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 57.6 mtt85 -99.67 -28.76 13.03 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . 175.66 -176.41 47.44 Favored Glycine 0 C--O 1.236 0.227 0 N-CA-C 112.171 -0.371 . . . . 0.0 112.171 -178.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 71.7 m . . . . . 0 C--O 1.245 0.864 0 CA-C-O 116.848 -1.548 . . . . 0.0 107.449 178.903 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -76.56 152.11 36.08 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 177.675 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 50.5 m -82.99 146.85 52.87 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 176.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -68.63 152.09 74.72 Favored 'Trans proline' 0 C--O 1.246 0.921 0 C-N-CA 116.277 -2.015 . . . . 0.0 113.171 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.4 m -69.93 164.01 24.75 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.805 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 46.9 t -55.93 -47.01 80.51 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.974 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -66.63 -34.17 77.27 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -66.16 -40.27 90.41 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -71.46 -34.69 70.45 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.64 0.733 . . . . 0.0 110.342 -179.541 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -57.12 -39.78 75.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.437 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -53.63 -38.52 64.15 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.938 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -72.96 -54.22 9.2 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.012 175.941 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.81 -48.07 76.04 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -61.85 -40.73 96.37 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 66.8 m -63.86 -41.07 97.87 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.612 179.686 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.73 -41.92 95.59 Favored 'General case' 0 CA--C 1.5 -0.961 0 C-N-CA 120.858 -0.337 . . . . 0.0 111.017 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.73 -46.14 73.81 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.273 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.253 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -67.78 -39.52 84.08 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -68.48 -30.55 69.42 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 120.717 0.294 . . . . 0.0 110.621 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.17 -18.84 65.45 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.6 mt -105.35 12.09 32.03 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.345 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -54.82 130.56 41.43 Favored 'General case' 0 C--O 1.21 -1.006 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.1 t -63.93 -41.19 91.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-O 122.152 0.977 . . . . 0.0 109.063 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -68.64 -28.49 66.94 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.919 -1.492 . . . . 0.0 113.24 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 66.3 m -158.93 76.2 3.28 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.66 146.64 49.38 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 115.702 -2.399 . . . . 0.0 111.794 178.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -137.31 91.32 2.6 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.749 0.785 . . . . 0.0 110.14 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 1.3 p -57.21 -46.97 84.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 -177.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -58.87 -30.97 68.13 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -177.681 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -70.2 -41.91 73.06 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.02 -49.46 72.3 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 176.56 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.7 mt -57.3 -42.61 82.11 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -176.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -65.17 -39.18 92.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.369 0.604 . . . . 0.0 111.407 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.62 -47.65 69.03 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.21 -44.78 79.83 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.389 177.638 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -66.8 -34.31 77.55 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 119.264 0.938 . . . . 0.0 113.493 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -69.1 -45.11 71.05 Favored 'General case' 0 C--O 1.225 -0.216 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 176.215 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.59 -33.37 66.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.543 0.687 . . . . 0.0 110.069 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.25 -16.17 64.34 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-O 119.181 -0.788 . . . . 0.0 114.656 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.7 t -114.82 -12.44 12.1 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.311 1.056 . . . . 0.0 110.815 179.346 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.1 mt -67.47 144.92 55.46 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.752 -0.593 . . . . 0.0 111.179 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -76.44 84.35 3.17 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-O 122.684 1.231 . . . . 0.0 109.279 177.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 29.1 m -97.99 46.91 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 CA-C-O 122.596 1.189 . . . . 0.0 109.127 -178.283 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.7 t -67.41 172.84 4.5 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 46.1 m -49.32 -33.92 14.42 Favored 'General case' 0 C--O 1.218 -0.596 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -174.313 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -53.33 -44.86 68.78 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -88.35 -42.6 14.93 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.418 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -39.17 78.54 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -175.196 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -70.26 -29.71 66.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.114 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -90.16 -2.45 58.07 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.345 -0.222 . . . . 0.0 110.95 177.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -129.61 45.48 2.8 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.759 0.79 . . . . 0.0 111.999 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.4 p -64.84 -28.53 69.62 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.731 -0.606 . . . . 0.0 112.515 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -67.04 -26.27 66.68 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.508 0.671 . . . . 0.0 111.885 178.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.84 -43.42 79.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 41.6 t -63.85 -35.43 73.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.63 -38.21 89.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 119.305 -0.378 . . . . 0.0 110.963 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.6 m -75.43 -39.24 59.13 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 118.999 0.818 . . . . 0.0 109.654 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 46.8 mt -57.57 -35.0 69.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.03 0.443 . . . . 0.0 111.394 178.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -64.66 -29.16 70.15 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.878 -0.514 . . . . 0.0 111.561 175.18 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -73.4 -49.02 29.27 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.622 0.248 . . . . 0.0 110.984 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -73.34 -21.9 19.01 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.963 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 -175.326 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.429 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -60.45 -18.35 50.72 Favored 'General case' 0 C--O 1.214 -0.785 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 176.639 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -118.81 19.37 13.14 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 122.911 0.484 . . . . 0.0 111.279 176.711 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -63.19 113.6 3.27 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 121.156 0.503 . . . . 0.0 111.842 -176.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -75.54 -30.97 59.91 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 115.686 1.736 . . . . 0.0 115.686 -176.009 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.65 -42.43 95.44 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.032 0.444 . . . . 0.0 112.159 -174.774 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -129.88 109.81 11.2 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.4 tptt -56.06 -42.47 76.7 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.938 178.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -55.7 -43.08 76.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.154 0.502 . . . . 0.0 111.795 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 69.2 t -57.99 -43.74 85.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 177.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -44.63 95.8 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.78 -47.74 77.02 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.605 -0.438 . . . . 0.0 112.013 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -68.59 -39.94 80.72 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.854 -178.407 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.42 -41.11 88.76 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.429 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.26 -48.33 78.63 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -42.15 95.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.253 0.549 . . . . 0.0 109.681 -179.408 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 77.3 t -70.57 -51.63 35.68 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.456 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -53.44 -45.26 69.4 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 122.526 0.33 . . . . 0.0 110.841 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 22.6 m -65.03 -36.91 85.9 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 122.925 0.49 . . . . 0.0 111.342 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 42.2 mtt85 -62.0 -28.95 69.93 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 121.672 -0.643 . . . . 0.0 110.661 176.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 5.5 mt -76.51 -31.72 57.84 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 -176.71 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 -31.64 72.48 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.81 177.785 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 16.2 m -81.64 -8.53 59.72 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 177.017 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -110.96 -16.9 13.42 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -118.82 177.44 16.41 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -178.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.254 1.317 0 C-N-CA 126.689 1.996 . . . . 0.0 106.888 -178.155 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.761 0 CA-C-O 118.592 -0.718 . . . . 0.0 109.568 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 54.47 32.28 16.41 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 121.836 0.827 . . . . 0.0 109.85 -176.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 62.8 p -140.43 67.39 31.08 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.463 -175.354 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -69.41 148.82 68.2 Favored 'Trans proline' 0 C--O 1.238 0.507 0 C-N-CA 116.918 -1.588 . . . . 0.0 113.112 -178.703 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.7 m -69.49 161.41 29.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.891 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.4 t -54.25 -45.91 67.88 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -65.03 -34.07 77.55 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.03 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -66.44 -41.36 89.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -73.21 -33.3 65.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.808 -176.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 5.1 tt -59.69 -35.49 74.6 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.631 178.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -58.12 -40.27 80.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 119.037 0.835 . . . . 0.0 110.053 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -65.32 -55.83 16.09 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.403 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -45.8 90.37 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -177.194 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -58.61 -42.72 88.82 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 -179.361 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 53.9 m -64.63 -39.08 93.07 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 121.197 -0.201 . . . . 0.0 111.434 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -63.54 -37.67 88.18 Favored 'General case' 0 CA--C 1.508 -0.653 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.6 178.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.6 mt -59.17 -43.02 88.55 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -63.45 -44.92 93.11 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.75 -32.4 73.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.79 0.329 . . . . 0.0 110.979 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.58 -17.34 64.6 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.3 mt -109.69 12.06 24.33 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -55.29 132.4 47.81 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 177.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.73 -41.45 92.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 122.316 1.055 . . . . 0.0 108.723 177.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -66.42 -31.22 71.85 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 113.519 -1.673 . . . . 0.0 113.152 -178.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 11.1 t -160.48 76.97 2.65 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -175.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -73.99 144.95 34.94 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 116.68 -1.747 . . . . 0.0 112.716 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -137.34 102.24 4.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.685 0.755 . . . . 0.0 110.88 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.11 -45.39 95.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -179.098 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -59.66 -31.9 69.97 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -70.1 -41.13 74.43 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -177.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -48.75 73.1 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 176.125 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 87.5 mt -56.94 -44.59 82.66 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -176.369 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -63.16 -39.04 93.51 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.799 0.809 . . . . 0.0 111.446 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -69.71 -47.27 63.74 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.448 0.642 . . . . 0.0 109.934 178.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.59 -48.26 75.13 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.641 178.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.36 -36.6 82.73 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -175.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -70.05 -45.7 66.55 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -35.77 70.42 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.295 0.569 . . . . 0.0 110.054 -179.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.91 -17.65 67.75 Favored Glycine 0 C--O 1.244 0.762 0 N-CA-C 115.288 0.875 . . . . 0.0 115.288 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.9 t -108.56 -13.43 14.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.512 0.656 . . . . 0.0 109.822 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.1 mt -69.99 149.47 47.7 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 35.4 tt0 -79.82 84.39 5.62 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-O 122.56 1.172 . . . . 0.0 109.281 177.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.3 m -98.16 47.93 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 CA-C-O 123.247 1.499 . . . . 0.0 107.608 -179.585 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.9 t -66.31 173.68 3.09 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 113.807 -1.542 . . . . 0.0 107.167 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.3 m -49.38 -34.67 16.69 Favored 'General case' 0 C--O 1.215 -0.713 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -54.28 -45.15 72.43 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 177.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.4 mp -86.52 -40.0 13.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 CA-C-O 121.691 0.758 . . . . 0.0 109.324 179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -38.16 81.13 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -175.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -67.1 -35.0 78.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.348 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -86.83 -6.86 58.67 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.116 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -128.74 45.64 2.75 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.914 0.864 . . . . 0.0 112.924 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.9 p -65.0 -24.23 67.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.357 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.08 -33.84 76.68 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.56 1.172 . . . . 0.0 112.231 178.322 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 86.1 t -68.43 -43.45 84.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 179.487 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.3 t -63.43 -37.1 78.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.36 -36.68 84.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.582 177.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.6 m -75.58 -39.73 57.64 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 118.215 0.461 . . . . 0.0 109.797 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 55.4 mt -58.19 -34.88 70.84 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.921 0.391 . . . . 0.0 111.257 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -64.22 -29.07 70.19 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.858 -0.526 . . . . 0.0 111.317 175.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -73.76 -46.02 48.27 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.72 0.295 . . . . 0.0 111.401 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -77.49 -20.6 14.07 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.164 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -176.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.465 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.21 -15.6 47.74 Favored 'General case' 0 C--O 1.211 -0.957 0 O-C-N 121.952 -0.467 . . . . 0.0 112.156 176.056 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -119.21 19.33 12.88 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.155 0.582 . . . . 0.0 111.456 176.067 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -63.75 116.25 5.55 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.276 0.56 . . . . 0.0 112.294 -175.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -83.18 -27.99 29.65 Favored 'General case' 0 C--O 1.216 -0.667 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -177.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.26 -27.38 66.28 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.981 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -147.97 114.94 6.12 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 177.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -63.12 -38.27 90.5 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -175.779 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -58.77 -38.94 79.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.919 0.39 . . . . 0.0 111.481 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.6 t -58.47 -44.64 89.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 177.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 3.3 ttp -64.22 -42.03 96.76 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 110.445 -0.206 . . . . 0.0 110.445 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.3 -49.43 74.04 Favored 'General case' 0 C--N 1.32 -0.713 0 O-C-N 123.191 0.307 . . . . 0.0 111.164 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.6 tptt -71.33 -38.05 71.7 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 118.868 -1.133 . . . . 0.0 111.335 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.7 -40.91 85.02 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.465 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.7 -51.12 66.42 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.748 -1.115 . . . . 0.0 113.904 178.263 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -44.03 90.16 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 -179.437 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.7 t -67.4 -51.23 54.56 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.957 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.811 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -54.26 -44.67 72.0 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -178.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 28.1 m -65.28 -39.21 92.26 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.132 0.573 . . . . 0.0 111.3 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 43.1 mtt-85 -57.95 -31.74 67.13 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 121.844 -0.535 . . . . 0.0 110.109 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 4.1 mt -76.62 -31.79 57.63 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -175.649 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 -38.89 91.25 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.772 177.386 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 18.1 m -74.9 -15.51 60.7 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 178.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.7 mtt-85 -98.17 -7.0 30.25 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -122.55 -173.23 14.18 Favored Glycine 0 CA--C 1.507 -0.421 0 CA-C-O 119.674 -0.514 . . . . 0.0 112.702 -174.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.256 1.42 0 CA-C-O 116.005 -1.95 . . . . 0.0 107.1 -177.336 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.982 0 CA-C-O 118.635 -0.697 . . . . 0.0 109.436 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -63.0 -36.58 84.04 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 175.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 25.0 m -100.74 147.04 33.1 Favored Pre-proline 0 C--O 1.244 0.81 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 172.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.03 151.38 82.02 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 118.395 -0.603 . . . . 0.0 113.261 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 5.5 m -74.1 166.01 24.14 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.181 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -53.35 -45.54 56.68 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.956 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . 0.41 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.2 OUTLIER -63.51 -33.62 75.98 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -178.825 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -70.59 -40.37 73.27 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -74.1 -31.66 62.9 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.708 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.34 -39.24 66.89 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.239 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -53.21 -38.74 63.14 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.4 0.148 . . . . 0.0 111.4 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -67.89 -58.22 4.93 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.332 176.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -46.48 88.87 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -174.414 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.2 t-160 -59.29 -41.15 88.27 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 59.5 m -65.64 -39.32 91.29 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 118.184 0.447 . . . . 0.0 111.46 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -63.28 -38.03 89.55 Favored 'General case' 0 CA--C 1.506 -0.721 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.92 178.929 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.63 -43.13 86.74 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.121 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 179.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 53.9 mmtt -63.18 -45.6 91.04 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.04 -33.1 75.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.885 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.78 -18.48 65.39 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 30.9 mt -108.45 12.02 26.51 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 -177.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 47.3 mttt -55.18 129.18 37.25 Favored 'General case' 0 C--O 1.21 -0.985 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 176.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 53.8 t -62.92 -41.81 94.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-O 122.261 1.029 . . . . 0.0 108.638 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -68.51 -26.77 65.62 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.592 -1.64 . . . . 0.0 113.573 -179.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 26.8 m -158.12 73.04 4.02 Favored Pre-proline 0 N--CA 1.473 0.722 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.21 145.14 34.31 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 115.728 -2.381 . . . . 0.0 112.79 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -137.23 97.78 3.57 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.714 0.769 . . . . 0.0 110.553 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.39 -46.57 85.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -179.412 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -58.42 -32.1 68.35 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -71.19 -40.64 71.09 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 -176.767 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -64.3 -49.43 71.83 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 175.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.6 mt -56.84 -43.28 80.94 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -176.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -65.54 -38.07 88.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.471 0.653 . . . . 0.0 111.795 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -66.04 -48.52 70.81 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.818 0.818 . . . . 0.0 109.33 177.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.23 -43.43 82.87 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.059 178.581 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -60.6 -37.47 81.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 119.035 0.834 . . . . 0.0 112.476 -177.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.02 -41.45 59.3 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.518 -0.873 . . . . 0.0 108.84 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.7 -34.01 69.0 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.422 0.629 . . . . 0.0 110.108 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.38 -19.31 66.42 Favored Glycine 0 N--CA 1.452 -0.29 0 N-CA-C 114.915 0.726 . . . . 0.0 114.915 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.7 t -112.41 -13.81 13.35 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.102 0.951 . . . . 0.0 110.925 -178.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.72 144.66 56.76 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.817 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -77.84 84.78 4.14 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-O 122.814 1.293 . . . . 0.0 109.561 178.176 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.6 m -97.22 48.11 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-O 122.862 1.315 . . . . 0.0 108.281 -178.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.6 t -66.62 172.75 3.9 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 22.5 m -49.22 -33.28 12.21 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -174.275 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -55.44 -44.32 76.22 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.323 -0.236 . . . . 0.0 111.442 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.4 mp -86.13 -42.06 15.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.049 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.41 -37.28 80.35 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -174.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -67.82 -31.75 71.82 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.524 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -89.73 -4.71 57.57 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 121.016 -0.273 . . . . 0.0 110.599 178.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -128.48 46.32 2.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.596 0.712 . . . . 0.0 112.24 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 25.7 p -65.59 -25.6 67.47 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 121.455 -0.778 . . . . 0.0 112.257 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.71 -29.08 68.24 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 122.682 1.229 . . . . 0.0 112.405 178.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 79.5 t -68.62 -44.74 82.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.4 t -63.86 -37.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.93 -35.35 79.82 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.867 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 92.3 m -77.46 -38.85 48.44 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 118.749 0.704 . . . . 0.0 109.41 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 43.8 mt -58.21 -35.21 71.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.06 0.457 . . . . 0.0 111.117 178.685 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -64.5 -29.11 70.15 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.923 -0.486 . . . . 0.0 111.486 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -74.29 -42.12 60.07 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.006 0.372 . . . . 0.0 112.006 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -78.84 -22.7 12.88 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.002 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 -178.047 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -16.87 55.99 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 176.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -118.74 19.34 13.19 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 123.323 0.649 . . . . 0.0 111.336 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -67.5 110.75 3.78 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -73.82 -30.34 62.65 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -176.784 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.1 -41.85 97.12 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -174.585 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -131.53 109.29 10.16 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -178.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -54.99 -43.34 73.46 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.97 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -55.03 -42.76 73.0 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.995 0.426 . . . . 0.0 111.999 -177.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 74.7 t -58.14 -44.46 87.57 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -62.53 -44.61 95.92 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.07 -47.16 78.25 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.38 -0.528 . . . . 0.0 112.185 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.0 tptt -68.67 -39.43 80.63 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.295 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.5 -40.23 86.39 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 121.59 0.709 . . . . 0.0 109.113 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -64.49 -48.95 73.26 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.703 -1.135 . . . . 0.0 113.113 179.181 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -42.74 90.74 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.7 t -69.45 -52.01 36.71 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.912 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.276 -178.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -54.0 -46.07 71.65 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 122.291 0.236 . . . . 0.0 110.661 -176.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 17.3 m -65.97 -35.28 80.15 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 122.884 0.474 . . . . 0.0 111.026 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -61.74 -29.69 70.28 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.775 -0.578 . . . . 0.0 110.154 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 8.6 mt -76.52 -32.13 58.09 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 -175.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.05 -28.89 69.92 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.601 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 23.0 m -80.19 -8.73 59.57 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.336 176.691 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 65.1 mtt85 -112.48 -23.04 10.52 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -167.46 163.21 36.96 Favored Glycine 0 C--O 1.236 0.238 0 N-CA-C 110.424 -1.07 . . . . 0.0 110.424 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 C--O 1.249 1.064 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -176.614 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.654 -0.688 . . . . 0.0 109.65 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 62.2 178.41 0.13 Allowed 'General case' 0 N--CA 1.473 0.697 0 O-C-N 124.627 1.204 . . . . 0.0 111.064 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 19.4 m -133.85 67.63 74.5 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.676 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.97 148.29 63.36 Favored 'Trans proline' 0 C--O 1.238 0.499 0 C-N-CA 117.323 -1.318 . . . . 0.0 113.433 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.0 m -68.78 164.47 21.77 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.5 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 40.1 t -54.16 -47.92 66.53 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 O-C-N 122.027 -0.421 . . . . 0.0 111.702 179.412 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -61.69 -34.18 75.3 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -178.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.13 -42.24 80.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 122.237 1.018 . . . . 0.0 108.46 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -71.65 -35.32 70.33 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.469 -177.64 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 4.6 tt -58.15 -35.38 71.45 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.72 178.408 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -56.7 -42.15 78.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 118.966 0.803 . . . . 0.0 109.778 177.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -68.37 -53.8 21.51 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.727 178.257 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -46.15 83.69 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 112.284 0.475 . . . . 0.0 112.284 -178.234 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.3 t-160 -58.09 -44.72 87.76 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.7 m -63.14 -38.22 90.31 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -64.66 -37.43 87.54 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.43 178.423 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.1 mt -58.92 -43.42 88.56 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.7 mmtt -63.66 -42.14 98.12 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -66.95 -34.69 78.32 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 120.788 0.327 . . . . 0.0 110.583 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -16.12 63.94 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 36.4 mt -111.94 12.08 20.72 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -58.56 133.24 55.66 Favored 'General case' 0 CA--C 1.489 -1.379 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 15.7 m -69.23 -16.13 20.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.022 177.682 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -91.89 -23.53 19.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.949 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 50.6 m -161.15 73.55 2.62 Favored Pre-proline 0 N--CA 1.469 0.494 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -175.577 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.35 142.55 33.65 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 113.822 -3.652 . . . . 0.0 112.381 178.388 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -137.36 101.86 4.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.589 0.709 . . . . 0.0 110.532 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -57.54 -45.4 86.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 13.2 pttt -59.53 -32.32 70.2 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-O 121.718 0.77 . . . . 0.0 109.605 -176.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -71.53 -39.63 70.6 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.064 -176.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.71 -49.15 66.97 Favored 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 91.4 mt -56.9 -43.3 81.21 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 111.519 0.192 . . . . 0.0 111.519 -176.839 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -65.89 -33.23 75.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.418 0.628 . . . . 0.0 112.204 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -72.62 -47.06 50.9 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.671 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.53 -45.87 80.9 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.439 179.434 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -60.46 -36.32 77.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 119.063 0.847 . . . . 0.0 112.688 -176.67 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.36 -47.32 43.23 Favored 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.76 -35.01 68.14 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.183 0.516 . . . . 0.0 110.768 -178.372 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.75 -18.05 69.88 Favored Glycine 0 C--O 1.241 0.592 0 N-CA-C 115.156 0.822 . . . . 0.0 115.156 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.0 t -108.63 -14.16 14.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 117.554 0.677 . . . . 0.0 110.059 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.4 mt -67.82 148.49 51.13 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 32.1 tt0 -79.09 84.25 5.1 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-O 122.734 1.254 . . . . 0.0 108.785 177.599 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 30.3 m -98.92 49.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.353 0 CA-C-O 123.133 1.444 . . . . 0.0 107.527 -178.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.4 t -67.1 173.15 3.94 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 34.4 m -49.32 -32.37 10.99 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -174.055 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.53 -44.46 76.72 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 177.698 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.05 -42.52 15.01 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 CA-C-O 121.62 0.724 . . . . 0.0 109.264 -179.152 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.48 -40.08 81.76 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -175.396 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -70.21 -31.05 68.32 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.191 -177.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -88.65 -7.85 55.64 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.397 178.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -126.29 40.85 3.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.564 0.697 . . . . 0.0 111.745 -178.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 11.6 p -62.66 -24.02 67.41 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 -179.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.4 -31.09 72.15 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.557 0.694 . . . . 0.0 112.102 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 24.3 t -70.92 -41.99 77.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 179.033 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 38.3 t -62.91 -38.46 81.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.48 -32.59 74.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.613 177.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.4 m -79.68 -39.38 31.46 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 37.1 mt -58.27 -35.65 72.1 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.199 0.523 . . . . 0.0 111.069 179.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -63.52 -29.09 70.41 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 122.117 -0.365 . . . . 0.0 111.412 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -74.07 -44.3 54.61 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 122.318 -0.239 . . . . 0.0 111.637 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -78.81 -19.96 13.02 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -176.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.429 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.86 -13.44 44.95 Favored 'General case' 0 C--O 1.212 -0.896 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 176.542 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -120.88 19.38 11.74 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 122.999 0.52 . . . . 0.0 111.505 176.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -64.98 118.82 9.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.111 0.482 . . . . 0.0 112.183 -177.043 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -83.79 -29.7 27.18 Favored 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -177.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.12 99.39 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.32 0.581 . . . . 0.0 111.488 -174.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.9 m120 -132.9 111.61 11.2 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -60.32 -36.53 78.13 Favored 'General case' 0 C--O 1.21 -0.993 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.793 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -57.1 -42.3 80.52 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.241 0.543 . . . . 0.0 112.138 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.4 t -58.5 -43.08 86.13 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.117 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 5.3 ttp -64.8 -40.82 95.86 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -63.87 -51.55 64.06 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -70.34 -38.79 74.91 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 119.289 -0.964 . . . . 0.0 111.751 -177.729 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.79 -39.4 80.96 Favored 'General case' 0 C--O 1.212 -0.878 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.429 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.71 -48.77 70.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.518 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -42.25 91.87 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.1 t -70.4 -50.29 47.08 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.452 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -55.93 -44.97 78.84 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.643 0.258 . . . . 0.0 110.36 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 19.1 m -67.63 -33.64 75.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.339 0.59 . . . . 0.0 110.954 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 10.9 mtt85 -61.44 -28.52 69.33 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 121.78 -0.575 . . . . 0.0 109.932 175.069 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 11.0 mt -76.68 -35.22 58.06 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 -175.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . 0.511 ' HA ' ' HZ1' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -63.94 -27.74 69.35 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.395 177.939 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.1 m -81.53 -8.77 59.76 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 114.693 -1.14 . . . . 0.0 111.739 177.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -113.8 -24.41 9.15 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -162.62 165.73 36.36 Favored Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 111.827 -0.509 . . . . 0.0 111.827 -178.108 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 7.5 m . . . . . 0 C--O 1.247 0.969 0 CA-C-O 118.68 -0.676 . . . . 0.0 112.712 -177.043 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -77.02 171.82 14.19 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 176.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 26.8 p -71.28 144.95 90.19 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 176.37 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -67.98 146.24 70.55 Favored 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 117.376 -1.283 . . . . 0.0 114.239 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.7 m -71.17 167.0 20.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.335 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 25.7 t -53.18 -48.63 54.12 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -179.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . 0.45 ' CD ' ' HZ3' ' A' ' 515' ' ' LYS . 0.3 OUTLIER -63.88 -34.09 77.16 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.698 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -66.17 -39.57 89.85 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -74.33 -35.87 63.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.03 -178.192 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 5.3 tt -59.03 -35.51 73.43 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.531 177.737 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -56.38 -41.03 75.57 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.287 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -69.64 -53.22 19.76 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.43 -46.35 83.65 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.015 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -59.39 -41.82 90.26 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.6 m -64.66 -41.16 96.28 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.289 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 16.3 mm-40 -62.79 -41.94 99.49 Favored 'General case' 0 CA--C 1.503 -0.841 0 CA-C-N 117.964 0.347 . . . . 0.0 110.648 178.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.93 -46.9 76.48 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.206 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -67.47 -37.52 83.04 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -67.41 -32.61 73.62 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.77 0.319 . . . . 0.0 110.265 177.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.34 -17.8 64.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 179.171 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 31.6 mt -105.84 12.06 31.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 2.9 mttt -54.81 129.01 35.56 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 176.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.27 -40.46 89.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 CA-C-O 122.809 1.29 . . . . 0.0 107.852 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -65.12 -28.48 69.46 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.81 -1.996 . . . . 0.0 113.441 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 69.5 m -162.26 75.45 2.17 Favored Pre-proline 0 N--CA 1.474 0.73 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -73.5 143.75 35.01 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 114.741 -3.039 . . . . 0.0 112.605 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -137.21 100.91 4.39 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.398 0.618 . . . . 0.0 110.09 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -59.5 -46.72 92.64 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.891 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -57.11 -32.06 65.92 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -69.9 -40.43 75.63 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 119.868 -0.733 . . . . 0.0 109.162 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.01 -48.33 74.3 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.033 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.1 mt -56.96 -44.38 82.55 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 117.944 0.338 . . . . 0.0 111.855 -176.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.2 t30 -61.6 -38.92 89.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.797 0.808 . . . . 0.0 111.541 179.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -69.72 -48.55 59.11 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.5 0.667 . . . . 0.0 109.791 178.155 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.44 -48.51 71.62 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.162 178.708 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.99 -35.82 79.65 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -175.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -46.73 61.68 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 176.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.04 -34.27 68.05 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.368 0.604 . . . . 0.0 110.247 -178.628 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.17 -17.47 68.08 Favored Glycine 0 C--O 1.241 0.533 0 N-CA-C 115.101 0.801 . . . . 0.0 115.101 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.8 t -110.99 -12.06 14.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 117.867 0.834 . . . . 0.0 110.081 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.1 mt -69.63 147.48 50.61 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 121.917 -0.489 . . . . 0.0 110.057 179.463 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -78.73 84.48 4.81 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-O 122.83 1.3 . . . . 0.0 108.965 177.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 28.4 m -99.05 46.32 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 -179.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.1 t -66.16 169.69 6.73 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 -177.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 22.9 m -49.29 -29.4 5.88 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 114.266 1.209 . . . . 0.0 114.266 -174.179 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -55.62 -47.53 76.42 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.309 -0.244 . . . . 0.0 111.322 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -86.03 -39.84 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 CA-C-O 121.424 0.63 . . . . 0.0 109.513 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -36.53 77.2 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -175.658 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -66.64 -32.94 74.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.786 0.803 . . . . 0.0 111.384 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . 0.45 ' HZ3' ' CD ' ' A' ' 472' ' ' GLU . 11.7 ptmm? -92.5 -1.13 57.18 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.997 -1.002 . . . . 0.0 111.753 179.961 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -132.29 43.25 3.03 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.663 0.744 . . . . 0.0 112.457 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 21.2 p -64.44 -25.57 68.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.14 -32.2 73.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.725 0.774 . . . . 0.0 112.354 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.5 t -68.39 -41.34 83.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.6 t -63.39 -37.01 78.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 178.417 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.72 -38.22 89.63 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.535 177.472 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 99.2 m -74.85 -38.11 62.06 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 118.5 0.591 . . . . 0.0 110.455 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 65.1 mt -58.82 -34.15 71.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.98 0.419 . . . . 0.0 111.034 178.21 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -65.08 -29.19 70.05 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.755 -0.59 . . . . 0.0 111.26 175.262 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -73.14 -42.73 62.54 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 122.239 -0.288 . . . . 0.0 111.441 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 2.2 pt -78.87 -24.13 13.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.04 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -178.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.59 -14.09 38.72 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 121.736 -0.602 . . . . 0.0 112.187 176.611 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -118.72 18.69 13.35 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.357 0.663 . . . . 0.0 111.516 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -68.74 106.26 2.59 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -175.736 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -75.97 -23.23 55.33 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.54 -24.4 64.63 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -177.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -151.67 126.18 9.47 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.511 -0.475 . . . . 0.0 112.062 174.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 46.4 tptt -62.21 -50.13 73.0 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.408 -178.425 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -57.82 -39.82 78.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.251 0.548 . . . . 0.0 111.455 -174.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 54.8 t -56.1 -45.36 80.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 176.829 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.8 ttp -67.41 -43.41 81.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.542 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -64.24 -47.64 78.89 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.0 tptt -69.48 -37.94 77.47 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.669 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.82 -41.57 87.17 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.27 -51.09 67.57 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.599 -1.182 . . . . 0.0 113.322 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -44.71 90.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 -179.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.5 t -67.75 -50.0 64.45 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.998 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.179 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -54.58 -44.58 73.12 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.6 m -65.46 -39.04 91.54 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 122.925 0.49 . . . . 0.0 111.317 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 35.8 mtt-85 -57.74 -31.74 66.76 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 121.874 -0.516 . . . . 0.0 110.447 175.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 3.3 mt -76.69 -31.7 57.4 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -37.83 88.62 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.45 178.267 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.2 m -70.2 -8.94 53.97 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 77.0 mtt85 -113.25 9.37 18.36 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.562 0.345 . . . . 0.0 110.129 177.606 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -94.8 -170.07 36.97 Favored Glycine 0 C--O 1.226 -0.401 0 C-N-CA 121.349 -0.453 . . . . 0.0 112.772 -176.356 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 C--O 1.243 0.738 0 C-N-CA 124.244 1.017 . . . . 0.0 111.833 -178.984 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 118.751 -0.643 . . . . 0.0 109.427 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -62.41 -34.67 77.19 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 175.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 29.9 m -104.57 145.1 30.05 Favored Pre-proline 0 C--O 1.244 0.787 0 N-CA-C 105.141 -2.17 . . . . 0.0 105.141 171.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -67.51 154.24 74.23 Favored 'Trans proline' 0 CA--C 1.533 0.453 0 O-C-N 122.213 0.586 . . . . 0.0 112.901 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.8 m -72.68 165.44 24.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.419 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 51.8 t -54.31 -47.55 68.82 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.947 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.874 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -63.38 -33.9 76.56 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 122.525 0.33 . . . . 0.0 111.781 -178.655 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -68.36 -41.56 80.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 178.413 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -72.74 -32.72 65.89 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.842 -176.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 1.2 tm? -56.35 -35.61 67.85 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.698 179.259 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -54.7 -39.95 68.68 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.952 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 39.1 tttt -66.46 -54.3 25.68 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 176.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -47.36 85.66 Favored 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -176.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -61.01 -40.57 94.06 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 66.1 m -64.04 -41.93 97.24 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.424 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -63.91 -42.69 97.35 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-O 119.426 -0.321 . . . . 0.0 111.349 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.43 -46.44 70.48 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.272 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -68.09 -38.42 82.33 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -176.858 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -68.37 -31.19 70.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.709 0.29 . . . . 0.0 110.245 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -19.17 65.71 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.5 mt -105.84 12.15 31.1 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -55.62 129.41 38.96 Favored 'General case' 0 C--O 1.209 -1.038 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 177.218 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.7 t -63.15 -40.64 89.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 122.363 1.078 . . . . 0.0 108.504 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -68.43 -27.14 65.92 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 113.491 -1.686 . . . . 0.0 113.148 -178.566 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 49.4 m -159.43 74.0 3.29 Favored Pre-proline 0 N--CA 1.47 0.563 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -176.495 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.45 145.93 43.59 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 114.701 -3.066 . . . . 0.0 112.372 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -137.3 91.74 2.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.523 0.678 . . . . 0.0 110.154 -176.015 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 1.1 p -57.37 -46.02 85.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -177.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -58.06 -31.36 66.98 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 120.843 0.354 . . . . 0.0 110.089 -177.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -70.9 -42.08 70.42 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 -177.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.26 -49.44 74.09 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 176.602 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 80.8 mt -57.01 -42.89 81.2 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -176.383 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -66.01 -38.35 88.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.297 0.57 . . . . 0.0 111.468 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -65.77 -48.25 72.45 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.658 0.742 . . . . 0.0 109.22 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.76 -44.52 81.85 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.552 177.425 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -62.41 -36.97 84.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 119.161 0.891 . . . . 0.0 112.32 -177.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -71.77 -43.92 64.9 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.8 -31.71 71.09 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.399 0.619 . . . . 0.0 110.246 -179.111 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.82 -17.41 62.84 Favored Glycine 0 C--O 1.24 0.517 0 CA-C-O 119.507 -0.607 . . . . 0.0 114.494 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 12.2 t -114.85 -13.36 11.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.742 0.771 . . . . 0.0 111.048 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.2 mt -67.0 146.41 54.39 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.197 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 35.5 tt0 -77.67 84.22 4.02 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 122.515 1.15 . . . . 0.0 110.17 178.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.9 m -98.27 47.56 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 CA-C-O 122.942 1.353 . . . . 0.0 109.079 -178.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.2 t -66.94 173.61 3.53 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 20.1 m -49.38 -32.99 12.61 Favored 'General case' 0 C--O 1.214 -0.794 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -173.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -55.44 -43.9 75.8 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 177.612 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -87.14 -41.85 14.94 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 CA-C-O 121.518 0.675 . . . . 0.0 109.32 179.46 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -38.08 81.32 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -174.64 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -67.62 -32.91 73.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.716 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -88.69 -7.38 56.42 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.671 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -123.49 40.58 3.69 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.122 0.487 . . . . 0.0 111.017 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 12.0 p -62.63 -29.53 70.69 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.638 -0.664 . . . . 0.0 112.766 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -63.17 -29.21 70.61 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.527 0.68 . . . . 0.0 111.633 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 46.9 t -71.45 -43.79 72.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 43.1 t -61.95 -39.99 85.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.02 76.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.293 177.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.8 m -77.57 -38.55 48.17 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 118.883 0.765 . . . . 0.0 109.939 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 55.1 mt -58.66 -34.32 71.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.148 0.499 . . . . 0.0 110.208 177.443 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 5.4 mtpp -61.73 -34.36 75.68 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.008 -0.432 . . . . 0.0 111.66 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -69.71 -45.51 68.08 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.728 0.299 . . . . 0.0 111.769 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 3.9 pt -78.42 -22.59 13.29 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -175.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.475 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -64.36 -12.28 40.82 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 121.903 -0.498 . . . . 0.0 112.168 175.367 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -121.38 18.95 11.39 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 122.604 0.361 . . . . 0.0 111.51 175.121 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -67.92 118.4 11.07 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -176.789 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -85.19 -26.15 26.94 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -177.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.63 -41.59 98.24 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.174 0.511 . . . . 0.0 111.367 -175.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -130.93 109.92 10.89 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.82 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -58.18 -39.31 78.61 Favored 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.801 178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -56.54 -42.79 79.09 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.385 0.612 . . . . 0.0 111.262 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 69.0 t -59.89 -44.06 93.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.801 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 29.3 ttm -57.98 -48.01 81.28 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 122.61 0.364 . . . . 0.0 110.4 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.68 -47.15 76.42 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -72.12 -37.31 69.5 Favored 'General case' 0 CA--C 1.513 -0.468 0 C-N-CA 118.148 -1.421 . . . . 0.0 110.778 -176.224 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.87 86.68 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 178.065 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.475 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.4 -49.92 71.89 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.04 -43.8 91.69 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 -178.823 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 65.1 t -69.18 -50.06 56.14 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.971 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.493 -176.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -54.31 -44.82 72.34 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.11 -0.329 . . . . 0.0 110.11 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.4 m -66.38 -36.22 82.31 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.914 0.486 . . . . 0.0 111.291 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 41.1 mtt-85 -60.47 -28.92 68.71 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.735 -0.603 . . . . 0.0 110.329 175.387 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 7.8 mt -76.77 -33.42 58.07 Favored 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -175.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -29.64 70.31 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.755 178.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.8 m -79.18 -14.31 59.16 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.173 176.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 71.9 mtt85 -104.54 -23.55 13.12 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -166.41 161.78 35.45 Favored Glycine 0 N--CA 1.453 -0.179 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 10.2 m . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.385 -0.817 . . . . 0.0 112.882 -177.006 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -75.17 171.34 14.33 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 176.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 24.9 m -69.96 145.14 93.88 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 177.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.5 150.87 75.67 Favored 'Trans proline' 0 C--O 1.238 0.524 0 C-N-CA 117.958 -0.895 . . . . 0.0 113.712 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.9 m -69.82 164.92 22.62 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.618 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 43.1 t -54.65 -48.02 72.15 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.14 0 O-C-N 122.042 -0.411 . . . . 0.0 111.824 179.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -60.25 -34.25 73.44 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -68.77 -42.89 76.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 122.166 0.984 . . . . 0.0 108.603 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -72.57 -34.84 67.75 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.332 -176.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.1 tt -57.0 -40.3 76.33 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.364 179.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -60.35 -37.18 79.87 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.59 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -68.72 -53.44 22.06 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.828 176.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -45.33 82.81 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 118.557 0.617 . . . . 0.0 112.191 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.4 t-160 -57.44 -43.78 84.18 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -179.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 48.7 m -64.63 -38.5 91.21 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -65.47 -35.8 81.97 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.046 178.845 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.4 -42.34 83.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.024 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -64.16 -45.25 89.29 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -65.13 -33.41 75.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.272 -178.207 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.83 -18.05 65.07 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 29.8 mt -108.56 12.08 26.26 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -177.537 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -54.49 129.69 36.94 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.8 t -62.94 -41.17 91.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 122.612 1.196 . . . . 0.0 107.819 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -65.63 -28.03 68.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.052 -1.886 . . . . 0.0 113.549 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 5.7 m -159.63 72.7 3.28 Favored Pre-proline 0 N--CA 1.473 0.691 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -176.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -73.4 143.01 34.18 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 114.281 -3.346 . . . . 0.0 112.509 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -137.22 100.44 4.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.581 0.705 . . . . 0.0 109.976 -178.155 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.7 -47.88 91.13 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.889 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -177.97 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -57.04 -32.05 65.78 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.9 ttt180 -68.84 -40.25 79.53 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 -177.476 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.85 -49.81 69.12 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 175.696 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 60.9 mt -56.54 -44.36 80.81 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -175.714 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -62.82 -39.95 95.87 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.716 0.769 . . . . 0.0 111.206 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -70.88 -45.68 63.97 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 121.745 -0.597 . . . . 0.0 110.0 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.58 -49.51 70.2 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.594 177.202 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -61.89 -36.06 80.16 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -175.672 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.38 -46.44 66.92 Favored 'General case' 0 C--O 1.223 -0.337 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.94 -33.64 67.2 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.498 0.666 . . . . 0.0 109.951 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.23 -17.53 68.27 Favored Glycine 0 N--CA 1.452 -0.288 0 N-CA-C 115.115 0.806 . . . . 0.0 115.115 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.2 t -111.87 -11.44 13.91 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.989 0.895 . . . . 0.0 110.241 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.2 mt -69.37 148.67 49.33 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 121.896 -0.503 . . . . 0.0 109.822 179.41 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 35.7 tt0 -78.25 84.15 4.47 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-O 122.49 1.138 . . . . 0.0 108.864 177.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.2 m -98.55 47.22 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-O 123.21 1.481 . . . . 0.0 107.708 -178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.3 t -66.8 171.93 4.82 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 -178.03 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.7 m -49.15 -33.69 12.65 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -173.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -55.62 -44.79 77.38 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 176.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 3.9 mp -83.63 -42.48 17.48 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 CA-C-O 122.036 0.922 . . . . 0.0 108.611 179.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -37.7 76.56 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -176.26 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -67.11 -33.44 75.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.425 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -89.35 -9.74 49.27 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.248 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -125.08 41.7 3.45 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.516 0.674 . . . . 0.0 112.002 -175.973 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 22.8 p -62.24 -27.43 68.99 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -66.95 -26.54 66.88 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 43.0 t -71.71 -42.26 70.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.037 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.2 t -63.33 -37.35 79.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.57 -34.46 77.86 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.872 177.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.1 m -77.27 -39.84 46.72 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 118.072 0.396 . . . . 0.0 110.203 179.47 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 54.1 mt -58.24 -35.37 71.61 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.082 0.467 . . . . 0.0 110.929 178.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -63.32 -29.01 70.4 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.062 -0.399 . . . . 0.0 111.348 175.219 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -74.58 -42.95 57.83 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.3 pt -78.78 -23.38 13.0 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.8 -17.13 47.63 Favored 'General case' 0 C--O 1.214 -0.784 0 O-C-N 121.994 -0.442 . . . . 0.0 111.955 176.406 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -118.68 19.13 13.3 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.01 0.524 . . . . 0.0 111.386 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -67.07 115.49 6.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.083 0.468 . . . . 0.0 111.992 -176.464 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -83.78 -21.99 32.0 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 -177.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -70.42 -22.45 62.72 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 120.527 -0.469 . . . . 0.0 112.119 -177.143 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -152.24 126.68 9.36 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.588 175.552 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.8 tptt -64.37 -47.8 77.9 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.555 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -57.75 -39.78 78.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.339 0.59 . . . . 0.0 111.347 -174.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 59.8 t -55.99 -45.15 80.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.121 176.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.2 ttp -65.87 -44.08 86.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.28 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.04 -46.69 80.2 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -69.43 -38.95 78.07 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.682 -0.807 . . . . 0.0 110.871 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.64 85.99 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.211 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -64.37 -50.98 65.56 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.439 -1.255 . . . . 0.0 113.361 179.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -42.13 89.53 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.55 -49.66 50.83 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.935 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.177 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -55.12 -44.82 75.37 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.5 m -66.4 -36.94 84.11 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 122.829 0.451 . . . . 0.0 110.997 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 5.7 mtt85 -58.32 -31.78 67.86 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.023 -0.423 . . . . 0.0 110.118 175.638 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 4.6 mt -76.64 -31.75 57.57 Favored 'General case' 0 CA--C 1.5 -0.958 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -176.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -38.86 92.59 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.153 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.2 m -69.82 -17.9 63.42 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 78.5 mtt85 -102.22 -0.66 32.7 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -99.78 -164.18 29.11 Favored Glycine 0 C--O 1.225 -0.424 0 N-CA-C 114.477 0.551 . . . . 0.0 114.477 -173.346 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 17.7 m . . . . . 0 C--O 1.243 0.728 0 C-N-CA 124.361 1.064 . . . . 0.0 112.174 -179.244 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 118.643 -0.694 . . . . 0.0 109.629 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 57.47 -159.82 0.25 Allowed 'General case' 0 CA--C 1.542 0.666 0 O-C-N 124.188 0.93 . . . . 0.0 109.967 -177.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 23.3 t -151.73 142.1 14.91 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.01 150.08 72.4 Favored 'Trans proline' 0 C--O 1.24 0.625 0 C-N-CA 117.615 -1.123 . . . . 0.0 113.497 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.9 m -69.4 167.8 15.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.645 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 41.1 t -55.87 -47.57 79.54 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.858 0 O-C-N 122.109 -0.37 . . . . 0.0 111.656 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -63.53 -33.95 76.71 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -67.73 -42.32 82.1 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -69.66 -33.25 72.32 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.63 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.16 -38.95 71.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.741 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -53.86 -39.53 65.73 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.855 -178.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -70.9 -55.43 8.46 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.34 -47.72 78.23 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.484 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -60.95 -40.31 92.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 64.6 m -64.85 -42.0 95.25 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.921 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -62.99 -41.79 99.66 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.03 178.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -54.41 -48.45 68.87 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.021 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.274 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -65.9 -40.51 91.6 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -176.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -68.88 -26.59 65.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.655 0.264 . . . . 0.0 111.004 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -72.5 -17.68 61.73 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 178.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 25.0 mt -103.93 12.14 34.66 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.356 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -55.27 128.01 32.01 Favored 'General case' 0 C--O 1.21 -1.019 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 178.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 52.5 t -63.0 -40.46 89.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 122.117 0.96 . . . . 0.0 109.46 179.323 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -65.87 -31.64 72.69 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 113.981 -1.463 . . . . 0.0 112.691 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 17.2 t -159.8 78.19 2.76 Favored Pre-proline 0 C--O 1.246 0.877 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.799 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.29 148.73 44.18 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 115.832 -2.312 . . . . 0.0 112.153 178.299 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -137.32 97.72 3.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.61 0.719 . . . . 0.0 109.093 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 70.8 t -59.13 -42.85 87.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.676 -178.427 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -60.46 -35.64 76.35 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.492 0.587 . . . . 0.0 110.871 -177.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 40.7 ttm180 -65.1 -43.07 93.25 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.097 0.475 . . . . 0.0 109.933 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.3 OUTLIER -65.27 -50.39 65.94 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 177.584 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 86.7 mt -56.9 -42.29 79.63 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 111.357 0.132 . . . . 0.0 111.357 -176.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -65.62 -38.57 89.81 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.35 0.595 . . . . 0.0 111.67 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -66.57 -47.18 73.6 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 177.798 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.35 -42.71 82.55 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.605 177.685 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -64.77 -37.15 86.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 119.073 0.851 . . . . 0.0 112.541 -177.474 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -69.83 -45.01 68.76 Favored 'General case' 0 C--O 1.225 -0.219 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 177.775 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.76 -35.31 68.49 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.291 0.567 . . . . 0.0 110.927 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.94 -19.27 67.53 Favored Glycine 0 C--O 1.24 0.506 0 N-CA-C 114.928 0.731 . . . . 0.0 114.928 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.3 t -109.06 -16.28 14.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 117.582 0.691 . . . . 0.0 110.091 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.7 mt -65.03 144.16 57.47 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.348 0.594 . . . . 0.0 109.935 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 -78.12 84.52 4.35 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 122.01 0.91 . . . . 0.0 109.747 177.225 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 35.5 m -98.92 45.0 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-O 123.008 1.385 . . . . 0.0 108.03 179.723 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.45 173.69 3.16 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.148 -1.387 . . . . 0.0 107.691 -177.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.28 -32.44 10.88 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 -173.556 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.49 -45.11 77.04 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -88.66 -39.23 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 0 CA-C-O 121.2 0.524 . . . . 0.0 109.718 179.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -35.82 75.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -175.125 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -64.74 -32.81 74.66 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.567 0.698 . . . . 0.0 111.71 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -95.05 1.16 55.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.592 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -132.2 42.97 3.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.845 0.831 . . . . 0.0 111.917 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.0 p -65.22 -28.65 69.51 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 121.673 -0.642 . . . . 0.0 111.905 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -67.38 -26.21 66.35 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.547 0.689 . . . . 0.0 111.991 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 65.5 t -70.24 -43.86 78.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 178.381 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 44.0 t -62.49 -35.3 69.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 178.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.43 -39.88 94.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 119.018 -0.515 . . . . 0.0 111.203 177.102 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 99.3 m -73.57 -39.15 64.87 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 119.33 0.968 . . . . 0.0 109.911 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 62.7 mt -57.87 -35.31 70.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.791 0.329 . . . . 0.0 111.09 178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -65.35 -29.04 69.73 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.751 -0.593 . . . . 0.0 111.548 175.702 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -73.15 -44.63 59.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.021 0.438 . . . . 0.0 110.631 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . 0.4 ' HA ' ' HB2' ' A' ' 529' ' ' TYR . 14.7 pt -78.26 -24.48 13.76 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.847 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -175.654 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.48 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -59.26 -19.37 45.4 Favored 'General case' 0 C--O 1.213 -0.833 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 176.039 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -118.67 19.12 13.31 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 122.911 0.484 . . . . 0.0 111.784 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . 0.4 ' HB2' ' HA ' ' A' ' 526' ' ' ILE . 7.9 t80 -73.19 104.62 4.31 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.232 0.539 . . . . 0.0 111.624 -176.389 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -68.32 -32.33 72.37 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 116.419 2.007 . . . . 0.0 116.419 -175.455 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.68 -44.33 94.05 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 122.195 0.998 . . . . 0.0 112.007 -176.551 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 67.1 m-20 -113.99 90.34 3.32 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 -174.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -53.22 -50.0 65.63 Favored 'General case' 0 C--O 1.207 -1.163 0 O-C-N 122.33 -0.231 . . . . 0.0 110.958 -179.143 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -58.9 -37.74 77.3 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.845 0.355 . . . . 0.0 111.625 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 42.7 t -57.62 -44.41 85.3 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.559 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.322 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -63.93 -44.94 91.38 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.53 -47.67 80.69 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -70.44 -40.24 73.89 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 119.552 -0.859 . . . . 0.0 110.648 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.89 -40.02 87.32 Favored 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.48 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -61.01 -49.41 77.51 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 178.062 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -44.31 95.66 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.44 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.54 -51.45 51.54 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.774 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.059 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -53.93 -46.2 71.46 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 122.787 0.435 . . . . 0.0 110.27 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 33.2 m -63.29 -38.96 93.21 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 122.966 0.506 . . . . 0.0 110.982 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -62.21 -29.75 70.6 Favored 'General case' 0 C--O 1.215 -0.734 0 O-C-N 121.69 -0.631 . . . . 0.0 110.803 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 5.2 mt -75.12 -30.73 60.92 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 -178.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -34.37 77.94 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.712 177.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.0 m -81.45 -12.19 58.98 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 177.357 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -97.55 -11.27 23.9 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 122.247 -0.283 . . . . 0.0 110.62 177.64 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -106.2 -177.64 23.48 Favored Glycine 0 C--O 1.225 -0.444 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 -176.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 29.5 m . . . . . 0 C--O 1.246 0.894 0 O-C-N 124.967 1.039 . . . . 0.0 109.682 -177.029 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -72.77 155.66 39.72 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.308 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 45.9 m -79.97 128.97 72.06 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -70.82 153.04 64.25 Favored 'Trans proline' 0 C--O 1.239 0.574 0 C-N-CA 117.914 -0.924 . . . . 0.0 113.224 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.9 m -67.96 164.01 20.88 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.189 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 38.0 t -54.17 -48.99 65.31 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.878 0 O-C-N 122.027 -0.421 . . . . 0.0 111.997 179.358 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -61.26 -34.2 74.78 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -178.891 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -67.47 -41.77 84.07 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -72.51 -35.47 68.12 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.942 -177.665 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 3.8 tt -58.29 -37.83 75.82 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.578 178.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -57.73 -41.87 82.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 118.593 0.633 . . . . 0.0 110.293 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -67.53 -53.17 30.79 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 120.378 -0.529 . . . . 0.0 110.089 178.478 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -44.7 86.47 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.658 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -58.31 -43.85 88.35 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.9 m -63.77 -37.66 88.19 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -65.78 -37.66 86.91 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.193 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -58.08 -45.51 88.35 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.115 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 24.4 mmtt -61.11 -45.63 93.9 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -64.17 -34.51 78.23 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.715 0.293 . . . . 0.0 110.639 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.73 -16.54 64.18 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.488 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.9 mt -109.99 12.11 23.8 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -56.78 130.62 46.39 Favored 'General case' 0 C--O 1.21 -1.024 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 46.2 t -62.5 -40.93 89.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 122.303 1.049 . . . . 0.0 108.863 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -67.19 -30.19 70.07 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.638 -1.619 . . . . 0.0 113.093 -178.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.6 t -160.93 76.4 2.53 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -175.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -75.54 146.46 30.81 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 116.896 -1.603 . . . . 0.0 113.053 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -137.21 99.96 4.13 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.447 0.641 . . . . 0.0 110.354 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.3 -46.17 81.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.781 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -58.43 -32.68 68.92 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 121.935 0.874 . . . . 0.0 109.773 -176.558 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -70.76 -39.87 73.01 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.325 -1.307 . . . . 0.0 108.835 -175.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.01 -50.14 65.29 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 175.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 79.2 mt -56.62 -43.09 79.88 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -175.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.74 -38.38 90.81 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.619 0.723 . . . . 0.0 111.868 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -71.24 -45.24 63.69 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 121.655 -0.653 . . . . 0.0 109.617 178.45 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.04 -48.14 73.82 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.804 177.243 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -62.33 -35.64 79.71 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -175.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -67.41 -49.4 63.96 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.96 -33.51 62.42 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.393 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.95 -18.52 70.78 Favored Glycine 0 C--O 1.24 0.471 0 N-CA-C 115.176 0.831 . . . . 0.0 115.176 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.5 t -109.95 -13.36 14.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 118.085 0.942 . . . . 0.0 110.225 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 5.2 mt -67.02 146.85 53.92 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 122.021 -0.424 . . . . 0.0 110.949 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 38.4 tt0 -78.65 84.43 4.75 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-O 122.544 1.164 . . . . 0.0 109.103 177.213 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.0 m -98.82 47.39 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-O 122.968 1.366 . . . . 0.0 108.708 -178.258 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.8 t -66.78 172.34 4.42 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 106.824 -1.546 . . . . 0.0 106.824 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.0 m -49.17 -32.87 11.06 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -173.705 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -55.39 -44.81 76.49 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -85.75 -41.83 15.63 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.448 0 CA-C-O 121.774 0.797 . . . . 0.0 109.231 179.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.69 -37.51 79.04 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -175.387 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -65.39 -31.98 73.38 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.604 0.716 . . . . 0.0 112.203 -178.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -93.72 -6.12 46.89 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.085 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -127.93 39.97 3.76 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.533 0.682 . . . . 0.0 111.819 -178.335 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 28.2 p -63.8 -24.83 67.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -61.83 -32.54 72.87 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.475 0.655 . . . . 0.0 112.313 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 21.3 t -71.32 -40.99 74.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.395 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 31.7 t -62.86 -38.36 81.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.655 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.42 -30.2 71.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.948 177.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.6 m -82.58 -39.26 22.51 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 31.9 mt -57.56 -36.53 71.79 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.285 0.564 . . . . 0.0 110.881 178.737 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -62.44 -28.55 69.88 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 122.165 -0.335 . . . . 0.0 111.536 175.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -76.96 -42.18 40.12 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 178.227 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -78.76 -22.23 12.95 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.106 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -177.303 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.429 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -60.52 -18.12 50.02 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 122.431 0.292 . . . . 0.0 111.547 175.674 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -118.67 19.38 13.22 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.198 0.599 . . . . 0.0 111.571 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -66.64 110.35 3.18 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.195 0.521 . . . . 0.0 112.187 -176.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -74.39 -28.05 60.92 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.15 -41.67 94.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -175.468 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -131.94 111.05 11.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 -178.244 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -55.58 -44.24 76.73 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.045 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -55.9 -42.74 76.45 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.004 0.431 . . . . 0.0 112.058 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -57.56 -44.38 84.97 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -62.83 -44.49 96.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.063 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.25 -46.89 78.74 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.3 tptt -69.04 -39.66 79.07 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 119.1 -1.04 . . . . 0.0 111.071 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.72 -40.26 87.4 Favored 'General case' 0 C--O 1.212 -0.87 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.426 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.429 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.42 -50.44 71.49 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.287 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -45.5 89.72 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 60.6 t -67.11 -49.57 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.979 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.202 -177.084 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -56.01 -44.98 79.21 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 26.6 m -66.12 -35.63 81.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.295 0.569 . . . . 0.0 111.161 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 54.2 mtt-85 -61.27 -27.81 68.74 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 121.705 -0.622 . . . . 0.0 110.469 175.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 9.9 mt -76.48 -35.78 58.22 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -176.516 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . 0.468 ' HA ' ' HZ2' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -63.36 -28.01 69.71 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 114.735 -1.121 . . . . 0.0 111.432 178.32 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.6 m -79.16 -8.69 59.2 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.662 178.137 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 73.0 mtt85 -117.64 -21.91 8.31 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -162.5 167.23 36.94 Favored Glycine 0 C--O 1.237 0.317 0 C-N-CA 121.342 -0.456 . . . . 0.0 112.187 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 8.7 m . . . . . 0 C--O 1.248 0.993 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -176.695 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -72.84 162.36 29.58 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 176.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.9 p -143.33 150.23 50.94 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 178.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.85 152.3 73.8 Favored 'Trans proline' 0 C--O 1.236 0.423 0 N-CA-C 113.839 0.669 . . . . 0.0 113.839 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.8 m -71.18 166.19 22.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.557 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 39.3 t -53.76 -48.41 61.25 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.05 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.16 -34.21 77.13 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -178.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.69 -39.92 88.32 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 179.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -74.16 -35.79 64.05 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.214 -178.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 5.2 tt -58.63 -38.68 78.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.047 -0.978 . . . . 0.0 109.332 178.254 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -55.21 -40.32 70.66 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -71.8 -53.61 12.81 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.27 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -45.84 79.47 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -178.32 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.9 t-160 -59.13 -41.94 89.44 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.5 m -65.21 -40.02 93.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 119.441 -0.314 . . . . 0.0 111.196 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 50.5 mm-40 -65.02 -40.51 94.98 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.368 178.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.9 mt -54.29 -48.5 67.35 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.06 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -65.89 -38.36 88.55 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -177.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -66.84 -32.35 73.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.664 0.269 . . . . 0.0 110.299 177.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -20.42 66.0 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.9 mt -101.15 12.05 38.32 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 12.6 mtpp -56.72 122.22 11.62 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 40.1 t -60.98 -39.04 80.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 122.481 1.134 . . . . 0.0 109.4 178.727 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -64.26 -28.21 69.57 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 113.525 -1.67 . . . . 0.0 112.811 -178.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -168.73 81.13 0.74 Allowed Pre-proline 0 N--CA 1.47 0.538 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.13 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.87 149.44 33.28 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 118.083 -0.811 . . . . 0.0 113.182 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -137.28 99.23 3.92 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.526 0.679 . . . . 0.0 110.871 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.96 -45.36 87.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -179.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -58.79 -32.13 69.05 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -69.49 -40.28 77.12 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.99 -49.92 66.1 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 176.053 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.64 -43.97 80.83 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -176.002 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -63.5 -37.45 87.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.565 0.698 . . . . 0.0 111.447 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -70.48 -47.49 60.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.365 0.603 . . . . 0.0 109.601 178.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.65 -49.01 71.61 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.227 178.021 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -61.73 -35.37 77.87 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -175.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -47.86 57.89 Favored 'General case' 0 C--O 1.224 -0.266 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 176.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.7 -34.02 67.04 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.401 0.62 . . . . 0.0 110.197 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.94 -17.89 68.09 Favored Glycine 0 C--O 1.236 0.259 0 N-CA-C 115.292 0.877 . . . . 0.0 115.292 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.9 t -110.86 -11.31 14.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 118.003 0.901 . . . . 0.0 110.235 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.7 mt -68.85 148.87 49.62 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 121.939 -0.475 . . . . 0.0 110.296 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 26.5 tt0 -77.28 84.48 3.72 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 122.719 1.247 . . . . 0.0 109.087 177.507 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 31.1 m -100.28 50.18 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 CA-C-O 122.969 1.366 . . . . 0.0 108.167 -178.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.1 t -66.53 171.87 4.64 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.398 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 40.4 m -49.32 -31.49 9.27 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -175.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -55.43 -45.08 76.8 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.1 mp -86.05 -42.88 16.19 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -37.98 81.82 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -175.307 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -69.23 -30.29 68.41 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.219 -178.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -89.16 -5.24 57.88 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 122.187 -0.321 . . . . 0.0 110.901 177.986 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -129.87 43.95 3.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.591 0.71 . . . . 0.0 112.426 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.8 p -63.66 -25.27 68.14 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.08 -31.61 72.91 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.001 0.905 . . . . 0.0 111.922 178.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 57.8 t -69.53 -42.84 80.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 179.073 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 26.5 t -62.72 -38.07 80.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.93 -39.05 93.41 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.334 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 92.6 m -73.68 -38.08 65.03 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 118.483 0.583 . . . . 0.0 110.464 -178.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 63.1 mt -58.7 -35.75 73.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.136 0.493 . . . . 0.0 110.593 178.222 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -65.77 -29.14 69.6 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.878 -0.514 . . . . 0.0 111.357 175.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -72.22 -45.51 59.97 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.915 0.388 . . . . 0.0 110.808 178.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 16.6 pt -78.75 -20.61 12.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.806 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 -176.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.4 OUTLIER -62.45 -17.56 59.69 Favored 'General case' 0 C--O 1.213 -0.864 0 O-C-N 121.783 -0.573 . . . . 0.0 111.897 176.022 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.7 19.35 13.21 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.217 0.607 . . . . 0.0 111.411 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -65.5 114.65 5.03 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.024 0.44 . . . . 0.0 111.943 -177.334 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -75.2 -29.92 60.48 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.45 -40.72 96.26 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -132.57 112.1 11.79 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.23 -178.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 40.2 tptt -56.67 -43.69 80.64 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.388 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -55.74 -43.27 76.46 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.189 0.441 . . . . 0.0 112.189 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 67.4 t -57.35 -44.51 84.35 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -63.85 -43.53 95.85 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.99 -47.94 75.74 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.858 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -69.28 -38.98 78.6 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 118.864 -1.134 . . . . 0.0 110.586 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.37 -41.26 88.88 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-O 121.442 0.639 . . . . 0.0 109.498 178.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.427 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.91 -48.25 77.34 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.913 -1.04 . . . . 0.0 112.924 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -41.51 92.58 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 52.8 t -70.6 -51.25 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.286 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -54.63 -45.9 73.83 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 122.499 0.32 . . . . 0.0 110.278 -177.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 16.0 m -65.78 -34.61 78.56 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.289 0.566 . . . . 0.0 111.197 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.01 -28.76 70.32 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 121.803 -0.561 . . . . 0.0 109.966 175.396 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 9.1 mt -76.57 -33.33 58.49 Favored 'General case' 0 C--O 1.207 -1.143 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 -176.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -27.28 69.15 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.208 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.5 m -79.13 -8.51 59.04 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.866 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 69.0 mtt85 -117.99 -26.05 6.54 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -162.11 165.71 36.04 Favored Glycine 0 C--O 1.237 0.297 0 N-CA-C 112.302 -0.319 . . . . 0.0 112.302 -177.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 9.2 m . . . . . 0 C--O 1.241 0.655 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -176.837 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 118.523 -0.751 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 53.4 35.05 19.47 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 124.022 0.826 . . . . 0.0 110.209 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 56.0 p -135.67 67.43 65.29 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.438 -174.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.4 149.76 63.32 Favored 'Trans proline' 0 C--O 1.243 0.762 0 C-N-CA 117.223 -1.385 . . . . 0.0 113.777 -178.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.7 m -71.45 168.17 18.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.184 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 51.7 t -55.86 -46.77 80.21 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 CA-C-O 120.879 0.371 . . . . 0.0 111.626 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -65.92 -34.1 77.36 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -67.92 -40.86 83.33 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 176.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -69.14 -34.66 75.37 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.035 -178.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -56.09 -39.9 72.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.398 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -53.4 -39.7 64.51 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.995 -178.721 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -70.69 -56.49 6.29 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.619 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -45.8 86.04 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -176.118 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -59.49 -42.65 92.61 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 58.5 m -63.59 -38.45 91.17 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.075 0.234 . . . . 0.0 111.306 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 10.8 mm-40 -64.25 -38.25 90.39 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.649 178.209 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 92.5 mt -59.93 -41.73 87.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.088 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 51.6 mmtt -64.5 -45.22 88.2 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 121.832 -0.543 . . . . 0.0 112.068 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -65.77 -32.17 73.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.712 0.292 . . . . 0.0 110.794 -178.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.63 -16.97 64.58 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 178.627 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 34.5 mt -111.21 12.3 21.8 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -177.214 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -54.19 133.33 44.38 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 177.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 63.5 t -63.81 -42.32 95.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 122.264 1.031 . . . . 0.0 108.393 176.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -68.29 -28.32 67.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.735 -1.575 . . . . 0.0 113.597 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 20.3 m -157.59 73.53 4.25 Favored Pre-proline 0 N--CA 1.472 0.645 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -72.25 143.37 39.38 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 115.194 -2.737 . . . . 0.0 112.204 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -137.28 100.65 4.31 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.689 0.756 . . . . 0.0 110.563 -178.714 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -47.28 91.58 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.867 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.943 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -57.59 -31.85 66.59 Favored 'General case' 0 CA--C 1.506 -0.716 0 O-C-N 123.301 0.376 . . . . 0.0 110.04 -177.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -70.88 -39.4 72.87 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -177.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.1 -48.96 69.2 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.86 -42.38 79.65 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.489 0.185 . . . . 0.0 111.314 -175.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -67.01 -36.8 82.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.44 0.638 . . . . 0.0 112.125 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -69.78 -45.86 67.05 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.45 -44.1 80.14 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.746 -1.116 . . . . 0.0 111.086 178.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -63.41 -37.39 87.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 119.156 0.889 . . . . 0.0 112.616 -177.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -70.51 -44.84 66.76 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 177.608 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.31 -35.79 67.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.237 0.541 . . . . 0.0 111.323 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.62 -20.35 69.95 Favored Glycine 0 C--O 1.24 0.506 0 N-CA-C 114.779 0.671 . . . . 0.0 114.779 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.2 t -107.14 -16.01 14.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 117.338 0.569 . . . . 0.0 110.081 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -65.47 145.53 56.01 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 28.2 tt0 -80.09 79.59 6.62 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-O 122.542 1.163 . . . . 0.0 109.167 178.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 29.6 m -94.07 47.18 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 CA-C-O 122.991 1.377 . . . . 0.0 107.628 179.426 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.21 173.69 3.02 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 -178.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 13.8 m -48.32 -34.98 11.44 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 -173.425 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -54.86 -44.19 73.79 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 177.728 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -87.68 -38.74 12.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.84 -36.75 79.91 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -175.885 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -65.88 -32.29 73.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.385 0.612 . . . . 0.0 111.983 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -93.24 -1.64 55.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.493 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -129.46 44.94 2.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.815 0.817 . . . . 0.0 112.099 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 23.7 p -65.51 -28.18 69.01 Favored 'General case' 0 C--N 1.32 -0.678 0 O-C-N 121.746 -0.596 . . . . 0.0 112.132 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -66.74 -27.21 67.43 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.663 0.744 . . . . 0.0 111.838 177.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.7 t -70.72 -43.6 77.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.8 t -63.53 -37.17 78.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.32 -33.71 76.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.918 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 80.1 m -78.69 -40.27 34.34 Favored 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 40.2 mt -57.61 -35.4 70.4 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.124 0.488 . . . . 0.0 110.933 178.17 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.04 -26.92 68.78 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.895 -0.503 . . . . 0.0 111.886 175.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -76.47 -43.38 40.1 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.2 pt -78.81 -22.08 12.9 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.988 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -177.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.455 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -64.49 -12.1 40.63 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 175.317 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -121.14 19.32 11.56 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.821 0.448 . . . . 0.0 110.474 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.7 112.78 3.0 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.494 0.664 . . . . 0.0 112.497 -174.419 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -78.37 -31.42 48.48 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.55 -26.96 65.68 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -175.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.6 122.35 10.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.164 0.507 . . . . 0.0 112.354 176.933 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -64.15 -40.4 96.07 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -61.85 -40.86 96.82 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.552 0.692 . . . . 0.0 109.986 -176.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.3 t -58.03 -43.21 84.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.089 176.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 32.5 ttm -59.73 -48.64 80.85 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-O 120.8 0.333 . . . . 0.0 110.852 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -68.14 -45.72 72.82 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -178.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 44.7 tptt -69.51 -38.5 77.61 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 118.931 -1.107 . . . . 0.0 110.482 -177.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -60.13 -38.93 84.54 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.922 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.455 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.62 -48.91 70.65 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.716 -1.129 . . . . 0.0 113.981 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -40.5 87.79 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 61.9 t -70.59 -53.02 24.16 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.867 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.563 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -53.8 -45.1 70.63 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 122.372 0.269 . . . . 0.0 111.22 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 25.3 m -65.05 -36.98 86.08 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.171 0.588 . . . . 0.0 111.157 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 37.2 mtt85 -62.08 -29.96 70.67 Favored 'General case' 0 C--O 1.216 -0.674 0 O-C-N 121.563 -0.711 . . . . 0.0 110.59 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 4.7 mt -76.38 -31.12 57.82 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -175.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . 0.465 ' HA ' ' HZ2' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -61.94 -42.49 99.17 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 175.722 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 18.0 m -68.63 -24.16 64.52 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 178.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -89.64 -4.72 57.65 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 122.194 -0.316 . . . . 0.0 111.011 177.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -134.59 48.95 0.92 Allowed Glycine 0 CA--C 1.51 -0.221 0 N-CA-C 112.029 -0.428 . . . . 0.0 112.029 -175.092 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 66.9 m . . . . . 0 C--O 1.253 1.27 0 N-CA-C 103.162 -2.903 . . . . 0.0 103.162 177.893 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -73.58 160.64 31.34 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 176.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 28.6 m -75.31 141.95 74.42 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 176.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -68.42 150.88 76.06 Favored 'Trans proline' 0 C--O 1.238 0.524 0 C-N-CA 117.928 -0.914 . . . . 0.0 113.5 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.6 m -70.04 164.57 23.72 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.798 -179.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 41.1 t -53.63 -46.09 60.67 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.947 0 O-C-N 122.016 -0.427 . . . . 0.0 112.103 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.03 -34.14 77.73 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -67.54 -40.2 85.03 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -73.07 -32.72 65.21 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.228 -177.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -57.43 -39.34 76.02 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.062 178.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -53.2 -39.83 63.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.87 0.304 . . . . 0.0 110.268 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -71.72 -57.28 4.51 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.866 177.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.79 -45.88 78.12 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -176.858 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -59.31 -42.01 90.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.9 m -65.14 -37.78 88.51 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 123.13 0.268 . . . . 0.0 111.476 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 46.5 mm-40 -64.74 -37.05 86.3 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.961 -0.695 . . . . 0.0 110.279 178.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -59.1 -42.58 86.99 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.063 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -62.51 -46.87 86.46 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -65.35 -33.13 75.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.89 0.376 . . . . 0.0 111.224 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.01 -17.32 64.61 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.6 mt -110.48 12.0 22.99 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -176.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -55.3 130.06 40.89 Favored 'General case' 0 C--O 1.208 -1.094 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 177.557 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 51.0 t -63.01 -40.49 89.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 122.267 1.032 . . . . 0.0 108.88 178.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.17 -29.87 69.68 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.756 -1.565 . . . . 0.0 113.011 -178.763 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 18.1 t -161.45 78.97 2.16 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.56 146.17 34.27 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 118.11 -0.794 . . . . 0.0 112.767 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -137.28 101.17 4.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.679 0.752 . . . . 0.0 110.804 -179.534 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -60.05 -45.26 95.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -179.149 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -61.76 -31.08 71.25 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -69.19 -41.3 77.33 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -178.075 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -65.0 -48.29 74.48 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.004 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 73.7 mt -56.69 -44.96 82.01 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.18 -41.0 97.93 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.799 0.809 . . . . 0.0 110.053 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.11 -48.16 68.97 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.339 0.59 . . . . 0.0 109.847 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.5 -45.76 84.54 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.379 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -63.25 -35.37 80.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 119.006 0.821 . . . . 0.0 112.475 -176.366 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -71.82 -43.8 64.98 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 177.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.18 -33.86 65.67 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.511 0.672 . . . . 0.0 110.657 177.736 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.1 -16.42 66.6 Favored Glycine 0 C--O 1.239 0.411 0 CA-C-O 119.204 -0.775 . . . . 0.0 114.526 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.8 t -113.9 -14.3 12.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 118.042 0.921 . . . . 0.0 110.889 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.5 mt -66.48 145.97 55.06 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.877 -0.514 . . . . 0.0 109.829 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 30.0 tt0 -79.11 84.42 5.09 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 122.836 1.303 . . . . 0.0 109.566 178.005 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.8 m -96.59 48.76 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-O 123.18 1.467 . . . . 0.0 107.996 -178.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.5 t -66.84 172.23 4.57 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 -178.17 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 2.7 m -49.26 -34.88 16.19 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -173.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -54.72 -44.63 73.67 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 177.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -86.12 -41.66 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.63 -38.86 82.51 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -175.32 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -69.33 -31.94 70.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.824 -177.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -88.42 -3.96 58.73 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.232 177.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -127.52 45.34 2.75 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.858 0.837 . . . . 0.0 112.465 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 17.5 p -64.91 -28.71 69.72 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 121.699 -0.626 . . . . 0.0 112.568 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -69.7 -22.5 63.41 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.503 0.668 . . . . 0.0 112.09 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 87.9 t -71.55 -45.17 69.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 177.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 50.6 t -62.94 -36.79 77.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.553 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.57 79.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.407 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.1 m -77.63 -39.08 46.42 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 118.47 0.577 . . . . 0.0 109.698 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 48.8 mt -59.11 -31.89 69.34 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.064 0.459 . . . . 0.0 111.464 179.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -64.73 -29.11 70.08 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.757 -0.589 . . . . 0.0 111.199 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -74.58 -42.59 58.46 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.3 pt -78.8 -22.42 12.92 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.905 0 N-CA-C 114.919 1.452 . . . . 0.0 114.919 -176.518 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.446 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -60.92 -18.8 58.83 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-O 120.845 0.355 . . . . 0.0 111.649 176.151 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -118.85 19.51 13.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.18 0.592 . . . . 0.0 111.508 178.648 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 14.0 t80 -66.8 118.48 10.38 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 122.661 0.384 . . . . 0.0 111.168 -178.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 44.1 mttp -83.13 -26.24 31.16 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 116.003 1.853 . . . . 0.0 116.003 -176.943 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.03 -40.57 96.62 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.614 -0.435 . . . . 0.0 111.564 -175.588 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -133.02 116.2 16.09 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.189 -178.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.9 tptt -57.48 -43.44 84.09 Favored 'General case' 0 C--O 1.21 -1.003 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -52.3 -45.91 65.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.077 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.8 t -58.52 -44.08 88.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.2 ttp -64.17 -44.31 92.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.32 -48.43 78.05 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.849 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.0 tptt -71.67 -38.62 70.63 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 118.315 -1.354 . . . . 0.0 111.961 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.04 -40.04 79.9 Favored 'General case' 0 C--O 1.212 -0.899 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.446 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.64 -51.07 68.7 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.09 178.325 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.59 -43.6 89.56 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 60.3 t -67.86 -51.27 51.8 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.809 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.233 -177.345 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -54.67 -44.87 73.7 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.653 0.263 . . . . 0.0 110.41 -177.488 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 40.5 m -63.81 -38.6 91.72 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 123.641 0.776 . . . . 0.0 111.315 179.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 66.2 mtt180 -61.69 -28.58 69.5 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 121.62 -0.675 . . . . 0.0 111.061 176.285 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 5.8 mt -76.52 -31.83 57.89 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 -176.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . 0.441 ' HA ' ' HZ3' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -61.25 -38.58 87.21 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.239 177.194 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 16.0 m -74.26 -19.03 60.64 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 67.2 mtt85 -99.33 -10.01 22.85 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -107.36 -169.73 22.05 Favored Glycine 0 C--O 1.227 -0.335 0 CA-C-O 119.802 -0.443 . . . . 0.0 113.476 -174.859 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.48 1.051 0 C-N-CA 126.057 1.743 . . . . 0.0 109.919 -179.4 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -68.81 150.64 47.6 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 176.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.5 m -150.97 152.86 32.35 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.02 148.71 70.44 Favored 'Trans proline' 0 C--O 1.238 0.51 0 C-N-CA 117.626 -1.116 . . . . 0.0 113.017 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.9 m -67.95 163.72 21.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.403 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 44.4 t -54.84 -46.92 75.43 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.049 0 O-C-N 122.047 -0.408 . . . . 0.0 111.539 179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -61.03 -34.21 74.5 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -68.19 -41.42 81.44 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.15 0.976 . . . . 0.0 108.453 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -73.32 -34.89 65.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.927 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.6 tt -57.57 -37.99 74.09 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.663 178.355 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.36 -38.65 80.97 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.286 -0.565 . . . . 0.0 110.205 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -68.44 -53.34 24.24 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 176.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.27 -45.77 87.25 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 17.6 t-160 -58.8 -42.84 90.05 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -179.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 65.7 m -63.59 -41.71 98.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 119.573 -0.251 . . . . 0.0 111.195 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -63.79 -40.84 97.63 Favored 'General case' 0 CA--C 1.501 -0.92 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.28 178.088 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.54 -45.8 71.29 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.039 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -68.08 -39.13 82.99 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -67.75 -31.38 71.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.998 0.428 . . . . 0.0 110.408 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.06 -18.61 64.72 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 122.633 0.373 . . . . 0.0 111.807 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 27.0 mt -107.39 12.16 28.27 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -54.91 129.77 38.79 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.0 t -61.25 -40.08 84.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 122.474 1.13 . . . . 0.0 108.852 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -66.33 -28.76 68.92 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 113.398 -1.728 . . . . 0.0 112.676 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 22.9 t -159.59 76.99 2.95 Favored Pre-proline 0 C--O 1.24 0.577 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -73.43 141.61 31.91 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 114.979 -2.881 . . . . 0.0 112.29 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -137.27 105.1 5.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.491 0.662 . . . . 0.0 110.444 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.81 -44.18 96.99 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -58.71 -32.69 69.41 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -178.388 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 22.7 ttp180 -68.51 -41.0 80.59 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -68.0 -48.98 64.27 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.624 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.89 -44.07 81.95 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -61.91 -38.22 87.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.654 0.74 . . . . 0.0 111.704 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -70.93 -47.46 58.93 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.499 0.666 . . . . 0.0 109.704 178.382 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.93 -47.89 73.83 Favored 'General case' 0 N--CA 1.428 -1.537 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.115 178.743 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -61.4 -35.74 78.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.434 0.902 . . . . 0.0 113.434 -175.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.65 -46.13 59.93 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.49 -33.87 68.48 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.337 0.589 . . . . 0.0 109.872 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.64 -16.65 68.05 Favored Glycine 0 C--O 1.239 0.429 0 N-CA-C 115.034 0.774 . . . . 0.0 115.034 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.4 t -112.76 -7.93 13.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 118.136 0.968 . . . . 0.0 111.017 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.7 mt -71.89 148.93 45.62 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 26.1 tt0 -79.4 84.33 5.32 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 122.757 1.265 . . . . 0.0 109.452 178.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 30.2 m -98.3 48.3 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 CA-C-O 123.028 1.394 . . . . 0.0 107.93 -178.517 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.0 t -66.24 172.44 3.89 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 -178.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 20.2 m -49.32 -33.25 12.84 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -174.166 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -55.48 -44.35 76.4 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 178.298 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -86.63 -41.4 14.89 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 CA-C-O 121.502 0.668 . . . . 0.0 109.348 179.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.35 -38.47 80.48 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -176.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -63.85 -31.37 72.52 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.641 0.734 . . . . 0.0 112.446 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -95.38 -5.87 42.29 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.447 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -127.91 39.25 3.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.465 0.65 . . . . 0.0 111.296 -178.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.8 p -62.56 -25.48 68.08 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -178.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.36 -31.78 73.02 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.424 0.631 . . . . 0.0 112.155 178.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 41.3 t -71.15 -40.87 75.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.4 t -62.5 -37.75 79.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 178.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.69 92.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.38 177.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.5 m -73.68 -37.99 65.05 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 118.383 0.538 . . . . 0.0 110.536 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 68.6 mt -59.36 -34.51 72.49 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.929 0.395 . . . . 0.0 110.815 178.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -65.57 -29.04 69.6 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.807 -0.558 . . . . 0.0 111.212 175.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -71.21 -45.88 62.38 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 120.816 0.341 . . . . 0.0 110.986 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 5.3 pt -78.79 -20.4 12.98 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.987 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -177.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.444 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.97 -12.48 38.08 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 121.678 -0.638 . . . . 0.0 112.537 176.919 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -118.83 15.78 13.47 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 122.527 0.331 . . . . 0.0 111.57 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 18.2 t80 -63.32 122.85 17.21 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.203 0.525 . . . . 0.0 112.005 -176.749 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -92.38 -26.3 18.11 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 116.484 2.031 . . . . 0.0 116.484 -177.378 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -62.7 -42.29 99.56 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.719 0.771 . . . . 0.0 110.559 -176.79 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -129.6 111.88 13.15 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -61.02 -38.05 84.73 Favored 'General case' 0 C--O 1.209 -1.038 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.731 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -57.15 -41.96 80.11 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 55.0 t -56.45 -43.28 77.4 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 6.9 ttp -66.47 -40.11 89.17 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 122.369 0.268 . . . . 0.0 110.759 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.24 -51.38 63.92 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 123.086 0.241 . . . . 0.0 110.368 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -70.16 -38.29 75.42 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 119.401 -0.92 . . . . 0.0 111.239 -177.616 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.35 -40.71 82.92 Favored 'General case' 0 C--O 1.213 -0.868 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.444 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.51 -47.79 74.75 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.896 -1.047 . . . . 0.0 112.854 179.294 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -42.59 92.13 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.1 t -70.59 -49.72 50.2 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.085 0 C-N-CA 122.883 0.473 . . . . 0.0 111.61 -177.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -55.63 -44.97 77.62 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -178.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.3 m -66.71 -36.29 82.15 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 122.792 0.437 . . . . 0.0 110.889 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 9.3 mtt85 -58.84 -30.21 67.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.979 -0.451 . . . . 0.0 110.263 175.245 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 8.7 mt -76.63 -34.79 58.32 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -176.064 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -30.45 70.73 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.674 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 25.3 m -78.01 -10.21 59.49 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.428 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 79.5 mtt85 -110.8 -27.42 8.87 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -167.09 161.76 35.59 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 121.471 -0.395 . . . . 0.0 112.524 -178.379 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 9.5 m . . . . . 0 C--O 1.243 0.742 0 CA-C-O 117.702 -1.142 . . . . 0.0 112.864 -178.158 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -152.44 172.18 16.92 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 104.899 -2.26 . . . . 0.0 104.899 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 44.7 p -77.47 150.73 79.96 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -67.74 156.02 67.66 Favored 'Trans proline' 0 C--O 1.238 0.485 0 C-N-CA 118.205 -0.73 . . . . 0.0 112.787 178.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.2 m -67.26 162.16 23.29 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.245 -178.176 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 41.9 t -53.9 -46.75 64.59 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -62.09 -34.16 75.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.74 0.305 . . . . 0.0 111.566 -177.536 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.47 -41.9 79.49 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -73.17 -34.09 65.83 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.281 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 3.0 tt -58.95 -35.87 73.87 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.481 178.119 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -59.11 -40.18 84.56 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.906 -0.718 . . . . 0.0 109.647 178.629 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -67.29 -54.16 23.25 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.151 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -45.18 81.53 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.8 t-160 -58.89 -41.8 88.03 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 57.4 m -65.3 -39.31 92.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 119.406 -0.331 . . . . 0.0 111.649 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 58.5 mm-40 -64.49 -41.01 96.71 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.846 178.415 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.88 -47.22 75.78 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.214 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 177.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -65.79 -38.43 88.98 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -67.3 -34.01 76.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.866 0.365 . . . . 0.0 110.414 177.788 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.6 -17.45 64.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.0 mt -107.28 11.93 28.71 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -177.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -57.2 129.69 42.88 Favored 'General case' 0 CA--C 1.497 -1.081 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 16.1 m -71.32 -19.53 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.079 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.942 -178.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.84 -27.91 30.51 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 113.47 -1.695 . . . . 0.0 110.823 -179.562 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 77.4 p -163.76 79.19 1.57 Allowed Pre-proline 0 C--O 1.241 0.623 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.897 -176.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -73.49 147.84 41.68 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 115.493 -2.538 . . . . 0.0 112.782 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -137.28 100.09 4.16 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.751 0.786 . . . . 0.0 109.726 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -60.5 -47.6 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.838 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -177.666 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -60.69 -30.15 69.75 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 -177.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.2 ttt180 -68.32 -41.59 80.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.38 -47.74 78.1 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 86.2 mt -57.37 -44.47 84.45 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -176.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -38.49 89.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.772 0.796 . . . . 0.0 110.115 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -69.16 -48.32 62.58 Favored 'General case' 0 C--N 1.321 -0.631 0 O-C-N 121.693 -0.629 . . . . 0.0 110.078 179.419 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -56.18 -48.25 76.72 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.882 178.255 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -62.15 -35.71 79.61 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -175.404 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -72.78 -43.09 63.24 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 119.02 -1.072 . . . . 0.0 108.602 177.256 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.48 -35.82 70.67 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.237 0.541 . . . . 0.0 110.325 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.8 -18.81 68.85 Favored Glycine 0 C--O 1.242 0.602 0 N-CA-C 114.996 0.758 . . . . 0.0 114.996 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.8 t -109.27 -10.31 14.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 117.717 0.758 . . . . 0.0 110.293 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.4 mt -71.16 148.89 46.92 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -79.76 84.26 5.59 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 122.261 1.029 . . . . 0.0 109.264 178.476 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 35.5 m -98.54 47.73 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.163 0 CA-C-O 123.344 1.545 . . . . 0.0 108.188 -178.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 13.3 t -68.16 173.73 4.47 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.5 m -49.37 -33.76 14.41 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -173.09 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -53.91 -43.43 69.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 177.62 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -88.63 -41.77 14.31 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 CA-C-O 121.979 0.895 . . . . 0.0 109.431 179.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -39.47 81.3 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -175.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -67.55 -32.43 73.19 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.649 -178.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -89.11 -10.02 48.89 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.935 -0.306 . . . . 0.0 111.202 179.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -125.65 40.99 3.62 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.484 0.659 . . . . 0.0 112.163 -176.113 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 23.8 p -63.51 -24.45 67.82 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -62.15 -31.82 72.36 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.022 0.439 . . . . 0.0 112.024 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 23.6 t -71.11 -40.27 75.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.429 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 49.0 t -62.56 -36.83 76.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 178.193 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.82 -37.52 87.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.825 177.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.5 m -75.89 -38.38 57.87 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 118.531 0.605 . . . . 0.0 110.017 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 46.4 mt -57.78 -34.96 70.16 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.951 0.405 . . . . 0.0 111.417 178.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -65.33 -29.09 69.79 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 121.976 -0.453 . . . . 0.0 111.376 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -73.7 -44.32 56.82 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.733 0.301 . . . . 0.0 111.189 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -78.23 -22.14 13.46 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.877 0 N-CA-C 114.323 1.231 . . . . 0.0 114.323 -176.783 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.4 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -62.6 -16.03 54.4 Favored 'General case' 0 C--O 1.214 -0.793 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 176.555 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -118.65 19.28 13.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.044 0.538 . . . . 0.0 111.61 177.568 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -69.5 95.11 0.8 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -63.64 -27.59 69.34 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -178.122 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.5 -31.06 72.11 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -176.098 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -144.77 108.24 4.63 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.7 tptt -53.96 -46.27 71.57 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.043 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -55.92 -43.42 77.35 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.038 0.446 . . . . 0.0 111.992 -176.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.53 -44.76 85.54 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.491 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.575 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.3 ttp -64.72 -42.85 94.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 119.283 -0.389 . . . . 0.0 110.279 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -64.52 -48.36 75.41 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.828 179.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -68.88 -39.16 79.96 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 118.978 -1.089 . . . . 0.0 110.908 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.18 83.84 Favored 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 109.084 -0.709 . . . . 0.0 109.084 177.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.99 -48.21 71.99 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.868 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -42.12 93.64 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.9 t -70.52 -51.43 37.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.921 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.578 -178.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -54.07 -44.84 71.46 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 -177.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.7 m -66.17 -34.84 78.96 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 123.111 0.564 . . . . 0.0 111.638 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 26.1 mtt85 -62.45 -31.18 71.86 Favored 'General case' 0 C--O 1.217 -0.648 0 O-C-N 121.771 -0.581 . . . . 0.0 109.698 175.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 5.7 mt -75.03 -34.69 61.91 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -176.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -59.79 -33.43 71.71 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.392 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.3 m -81.6 -16.12 52.53 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -97.65 -15.14 20.56 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 122.21 -0.306 . . . . 0.0 111.758 179.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -158.21 -90.7 0.08 OUTLIER Glycine 0 C--O 1.227 -0.326 0 C-N-CA 121.26 -0.495 . . . . 0.0 112.972 -177.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--O 1.25 1.119 0 CA-C-O 115.694 -2.098 . . . . 0.0 105.602 -179.243 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.746 0 CA-C-O 118.528 -0.749 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 54.14 42.48 31.54 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 123.954 0.784 . . . . 0.0 109.663 -177.175 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 5.1 m -122.33 71.93 36.6 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.198 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.09 156.15 65.96 Favored 'Trans proline' 0 C--O 1.24 0.611 0 C-N-CA 118.2 -0.734 . . . . 0.0 113.048 -179.227 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.1 m -66.75 165.21 15.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.145 -178.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 53.3 t -56.08 -47.23 80.74 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.771 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -64.08 -34.24 77.58 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -67.27 -43.64 81.33 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.991 0.901 . . . . 0.0 108.783 177.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 24.8 mttt -69.04 -34.27 74.94 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.0 -178.144 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -58.63 -36.98 74.93 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.355 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -54.92 -40.78 70.23 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.04 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 62.6 tttt -68.97 -55.06 12.06 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 176.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.23 -46.87 79.37 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -176.357 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -60.88 -40.61 93.65 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.0 m -63.98 -41.89 97.39 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.549 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.5 mm-40 -63.12 -42.89 99.61 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 118.004 0.365 . . . . 0.0 110.872 178.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.63 -47.49 72.49 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -67.2 -37.32 83.47 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -177.079 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -67.15 -33.73 76.05 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.569 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.0 -17.36 64.89 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 27.9 mt -107.06 12.08 28.94 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -56.05 132.42 50.05 Favored 'General case' 0 C--O 1.21 -1.006 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 177.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.84 -41.1 91.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 175.645 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -65.55 -28.76 69.39 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.056 -1.884 . . . . 0.0 113.782 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 19.0 m -159.93 72.85 3.15 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -176.189 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.41 141.49 28.58 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 114.18 -3.413 . . . . 0.0 112.27 179.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -137.27 100.15 4.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.579 0.704 . . . . 0.0 110.214 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -58.16 -46.55 88.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.433 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -57.87 -31.93 67.19 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -178.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -70.82 -39.88 72.79 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 -176.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.42 -48.61 72.21 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.6 mt -56.83 -42.94 80.52 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -176.252 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -65.0 -38.44 90.97 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.424 0.63 . . . . 0.0 111.836 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -68.42 -47.53 67.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.579 0.704 . . . . 0.0 109.582 178.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.07 -48.11 73.95 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.875 177.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -63.96 -34.12 77.26 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -175.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -69.56 -46.88 65.37 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 176.295 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -58.44 -33.6 69.89 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.191 0.52 . . . . 0.0 110.901 -178.754 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.81 -18.29 63.95 Favored Glycine 0 C--O 1.235 0.191 0 CA-C-O 119.451 -0.638 . . . . 0.0 114.359 179.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.1 t -111.36 -12.44 14.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.911 0.856 . . . . 0.0 110.466 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.9 mt -68.87 146.48 52.79 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.982 -0.448 . . . . 0.0 110.228 179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 36.5 tt0 -79.22 84.4 5.18 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 122.762 1.267 . . . . 0.0 110.21 178.692 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.0 m -96.19 45.8 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 CA-C-O 122.8 1.286 . . . . 0.0 109.11 -178.547 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.1 t -66.47 171.31 5.08 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -177.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.5 m -49.26 -30.19 6.9 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -174.51 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -55.43 -45.71 76.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.522 0.201 . . . . 0.0 111.475 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.75 -40.3 13.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.283 0.563 . . . . 0.0 109.819 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.91 -34.93 75.42 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -174.941 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -64.62 -31.68 73.01 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.786 0.803 . . . . 0.0 111.817 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -95.34 -3.04 47.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.899 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -126.19 38.91 4.05 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.163 0.506 . . . . 0.0 110.526 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.5 p -63.81 -29.27 70.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -63.58 -26.74 68.83 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.586 0.708 . . . . 0.0 111.83 177.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 38.4 t -71.66 -42.85 71.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 -179.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.2 t -62.82 -35.96 73.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.11 85.69 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.06 176.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 98.0 m -77.91 -38.54 45.44 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 118.958 0.799 . . . . 0.0 110.011 -179.503 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 45.0 mt -57.52 -35.13 69.87 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.01 0.433 . . . . 0.0 111.393 178.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -64.95 -29.03 69.93 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.948 -0.47 . . . . 0.0 111.538 175.567 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -73.43 -45.14 56.26 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.768 0.318 . . . . 0.0 111.259 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -77.06 -23.4 14.82 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.923 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -176.405 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.438 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.2 OUTLIER -60.2 -19.32 53.69 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 176.413 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -118.64 19.32 13.27 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.093 0.557 . . . . 0.0 111.897 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -63.59 109.68 1.74 Allowed 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -176.501 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -72.51 -29.27 63.46 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -177.691 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.65 -24.84 64.58 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -174.333 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -150.79 119.25 6.44 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.774 -0.371 . . . . 0.0 110.422 178.26 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -61.38 -45.94 92.27 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.121 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -56.89 -40.36 76.1 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.185 0.517 . . . . 0.0 111.515 -175.396 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.7 t -56.05 -45.09 80.34 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -64.55 -43.93 92.37 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 119.12 -0.467 . . . . 0.0 110.08 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.54 -47.59 78.21 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.305 -0.558 . . . . 0.0 111.99 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -68.72 -40.28 80.0 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 119.627 -0.829 . . . . 0.0 110.934 -178.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.94 86.89 Favored 'General case' 0 C--O 1.213 -0.852 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.438 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.12 -48.79 74.71 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.354 -0.839 . . . . 0.0 113.15 179.087 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -43.96 95.0 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 59.0 t -68.69 -50.13 58.14 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.676 -178.253 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -54.68 -45.03 73.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.657 0.265 . . . . 0.0 110.374 -177.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 10.3 m -67.15 -34.13 76.92 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.755 0.312 . . . . 0.0 111.273 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -60.76 -28.94 69.09 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.613 -0.68 . . . . 0.0 109.732 175.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 9.2 mt -76.39 -34.24 58.87 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -174.772 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . 0.441 ' HA ' ' HZ2' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -62.86 -29.09 70.48 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.418 178.478 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.6 m -79.63 -8.6 59.31 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.456 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 74.0 mtt85 -113.65 -25.63 8.62 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -161.14 162.41 33.67 Favored Glycine 0 N--CA 1.453 -0.221 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -178.525 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 11.2 m . . . . . 0 C--O 1.243 0.75 0 CA-C-O 118.261 -0.876 . . . . 0.0 113.134 -177.06 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 119.0 -0.524 . . . . 0.0 109.624 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -67.36 -33.19 74.72 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 117.841 0.291 . . . . 0.0 111.518 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 15.4 m 46.73 58.98 16.63 Favored Pre-proline 0 N--CA 1.474 0.756 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -70.74 161.12 47.16 Favored 'Trans proline' 0 C--N 1.349 0.592 0 N-CA-C 114.986 1.11 . . . . 0.0 114.986 -177.441 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 8.9 m -68.7 163.86 22.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.342 -0.845 . . . . 0.0 113.091 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 35.6 t -53.86 -47.13 64.14 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.132 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -64.7 -34.31 78.01 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 120.718 0.294 . . . . 0.0 111.41 -176.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -67.25 -41.33 85.78 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -73.27 -33.61 65.35 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.891 -176.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 5.0 tt -56.74 -35.58 68.77 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.005 178.88 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -55.5 -41.02 72.49 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.253 0.479 . . . . 0.0 110.634 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -66.38 -54.68 21.59 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 177.376 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -47.23 85.18 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -176.505 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 14.6 t-160 -58.98 -43.08 91.34 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.706 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 62.2 m -64.13 -39.03 93.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 117.752 0.251 . . . . 0.0 111.619 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -64.23 -37.26 86.84 Favored 'General case' 0 CA--C 1.501 -0.935 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.595 179.001 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.14 -44.0 86.62 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.993 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 178.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.3 mmtt -62.94 -43.08 99.76 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.606 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -67.59 -34.12 76.38 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.73 0.3 . . . . 0.0 111.02 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.84 -15.29 63.52 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 29.7 mt -111.46 12.17 21.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.526 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -58.04 141.4 50.05 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 121.96 0.886 . . . . 0.0 109.562 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 70.7 t -65.42 -36.29 77.33 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 CA-C-N 113.86 -1.518 . . . . 0.0 107.808 174.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -74.92 -29.47 60.97 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.127 -1.851 . . . . 0.0 112.238 -173.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 10.2 t -165.98 79.54 1.14 Allowed Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.589 -175.228 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -73.07 142.5 34.52 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 115.082 -2.812 . . . . 0.0 112.163 176.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.4 t0 -137.13 100.34 4.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.451 0.643 . . . . 0.0 110.383 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -55.5 -46.01 78.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -178.894 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -32.61 68.91 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-O 121.974 0.892 . . . . 0.0 109.933 -176.798 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -70.41 -40.55 73.8 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.269 -1.332 . . . . 0.0 108.633 -176.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -50.31 65.57 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 175.305 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.7 mt -56.82 -42.83 80.3 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -65.52 -37.89 88.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.585 0.707 . . . . 0.0 111.655 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -69.77 -46.88 64.83 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.622 0.725 . . . . 0.0 109.694 178.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.92 -49.34 71.53 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.873 177.677 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -59.32 -36.58 75.91 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.8 -44.59 61.32 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.4 -34.79 72.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.059 0.457 . . . . 0.0 110.459 -178.36 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.46 -16.48 65.27 Favored Glycine 0 C--O 1.24 0.491 0 N-CA-C 115.359 0.904 . . . . 0.0 115.359 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.4 t -113.01 -12.19 13.26 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.413 0.607 . . . . 0.0 110.633 -179.452 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -67.64 149.19 50.38 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -77.28 84.51 3.73 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-O 122.537 1.16 . . . . 0.0 108.979 177.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.9 m -98.73 47.59 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 CA-C-O 122.96 1.362 . . . . 0.0 108.194 -178.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.0 t -66.21 173.43 3.16 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 -179.246 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.8 m -49.33 -33.65 13.87 Favored 'General case' 0 C--O 1.211 -0.949 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -174.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -55.35 -45.44 76.47 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.202 -0.311 . . . . 0.0 111.771 177.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.1 mp -83.76 -42.52 17.4 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.92 -37.32 79.11 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -175.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -66.78 -32.89 74.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.477 0.18 . . . . 0.0 111.401 -179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -88.87 -6.44 57.32 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.843 179.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -129.89 44.35 2.98 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -178.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 32.3 p -64.88 -24.76 67.63 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.84 -33.26 75.59 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 122.399 1.095 . . . . 0.0 112.317 178.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 91.5 t -67.69 -43.18 86.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 179.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.4 t -64.28 -37.45 79.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.91 -34.5 78.1 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.642 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 87.4 m -76.59 -39.64 51.98 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 51.9 mt -58.62 -34.79 71.55 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.1 0.476 . . . . 0.0 110.926 179.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -64.65 -29.18 70.18 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.912 -0.493 . . . . 0.0 111.32 175.086 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -73.05 -44.75 60.27 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 122.283 -0.261 . . . . 0.0 111.654 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -78.43 -20.57 13.27 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.905 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 -176.362 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.403 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.4 OUTLIER -62.19 -17.41 58.04 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 177.165 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -118.72 19.31 13.21 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.174 0.59 . . . . 0.0 112.128 176.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 13.2 t80 -63.8 117.68 7.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.06 0.457 . . . . 0.0 112.211 -177.482 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -75.97 -31.47 59.03 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.11 -41.73 97.14 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -173.303 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -133.21 118.27 18.42 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -178.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -58.8 -45.7 89.27 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.362 178.638 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -56.07 -41.75 75.59 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -176.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 68.6 t -56.57 -44.94 81.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.658 0 O-C-N 121.87 -0.519 . . . . 0.0 109.813 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.7 ttp -64.07 -43.89 94.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 119.167 -0.444 . . . . 0.0 109.846 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.89 -47.39 77.98 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.326 -0.55 . . . . 0.0 112.085 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -70.11 -37.96 75.5 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 119.089 -1.045 . . . . 0.0 111.253 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.54 -40.65 87.93 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.153 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.403 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.41 -49.23 72.35 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.543 179.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.36 -43.23 88.3 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 55.2 t -70.32 -49.98 49.87 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.041 0 C-N-CA 122.924 0.49 . . . . 0.0 111.318 -177.758 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -55.44 -45.82 76.81 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -178.144 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 17.6 m -66.18 -35.18 79.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.515 0.674 . . . . 0.0 111.029 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 13.1 mtt85 -60.82 -30.32 70.01 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.993 -0.442 . . . . 0.0 109.952 174.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 8.3 mt -76.55 -34.48 58.5 Favored 'General case' 0 C--O 1.208 -1.119 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 -176.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -28.19 69.22 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.587 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 25.2 m -78.24 -8.58 58.52 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.67 -1.15 . . . . 0.0 111.946 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -117.23 -21.68 8.66 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -169.31 163.53 37.17 Favored Glycine 0 CA--C 1.519 0.303 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 10.9 m . . . . . 0 C--O 1.248 1.015 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -176.301 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 55.38 36.89 28.04 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.912 0.758 . . . . 0.0 111.249 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 15.0 m -133.45 79.17 61.03 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.207 -178.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.32 161.69 44.85 Favored 'Trans proline' 0 C--O 1.237 0.469 0 O-C-N 122.089 0.521 . . . . 0.0 112.721 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 7.3 m -64.57 160.46 19.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.013 -0.539 . . . . 0.0 112.399 -177.605 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . 0.47 HG12 ' H ' ' A' ' 472' ' ' GLU . 0.1 OUTLIER -53.06 -54.21 18.23 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.137 0 CA-C-O 121.967 0.889 . . . . 0.0 112.134 -179.627 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . 0.47 ' H ' HG12 ' A' ' 471' ' ' VAL . 1.6 pt-20 -54.24 -34.24 60.24 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 113.744 -1.571 . . . . 0.0 113.423 178.822 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -69.85 -43.8 71.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 122.531 1.157 . . . . 0.0 108.167 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -70.06 -32.77 71.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.564 -177.245 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.5 tt -56.99 -35.66 69.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.447 178.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -58.5 -40.75 83.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.523 0.601 . . . . 0.0 109.92 178.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -66.85 -54.89 17.86 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 110.334 -0.247 . . . . 0.0 110.334 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -43.31 90.98 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.569 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 14.5 t-160 -57.31 -44.05 83.78 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.466 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.9 m -63.95 -38.5 91.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.485 0.18 . . . . 0.0 111.485 -179.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -63.3 -38.65 91.98 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.28 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.9 mt -58.22 -43.95 86.86 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -62.85 -44.74 95.32 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -178.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -66.36 -31.8 72.8 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.023 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.2 -18.39 65.23 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.897 0.702 . . . . 0.0 112.897 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 20.9 mt -106.84 12.14 29.29 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -177.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -54.72 130.15 39.52 Favored 'General case' 0 C--O 1.208 -1.119 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 178.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 55.8 t -63.5 -42.2 95.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 122.056 0.931 . . . . 0.0 109.471 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -67.6 -30.86 70.56 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 113.979 -1.464 . . . . 0.0 112.975 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 13.8 t -160.08 77.55 2.73 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.002 -175.416 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.61 149.23 34.01 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 117.123 -1.451 . . . . 0.0 112.383 179.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -137.21 97.77 3.57 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.857 0.836 . . . . 0.0 110.078 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -58.22 -46.36 88.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -179.212 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -59.74 -31.38 69.58 Favored 'General case' 0 CA--C 1.504 -0.811 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -177.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -69.08 -41.6 77.32 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.53 -47.89 77.12 Favored 'General case' 0 C--O 1.21 -1.021 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 175.912 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 84.6 mt -57.68 -44.06 85.52 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 118.045 0.384 . . . . 0.0 111.346 -176.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -63.07 -40.88 99.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.735 0.779 . . . . 0.0 110.901 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.14 -46.65 73.44 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.762 0.791 . . . . 0.0 109.529 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.11 -51.16 68.91 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.337 178.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -61.44 -35.66 78.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -175.142 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.26 -43.25 64.6 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 118.775 -1.17 . . . . 0.0 108.473 177.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -33.31 67.6 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.359 0.599 . . . . 0.0 109.895 178.385 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.62 -17.68 69.21 Favored Glycine 0 C--O 1.238 0.379 0 N-CA-C 114.833 0.693 . . . . 0.0 114.833 179.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.3 t -110.5 -14.83 14.03 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 117.714 0.757 . . . . 0.0 110.402 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.4 mt -66.51 149.28 50.68 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.008 -0.433 . . . . 0.0 110.211 179.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -78.76 84.4 4.83 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-O 122.324 1.059 . . . . 0.0 111.916 -178.783 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 17.5 m -106.93 76.9 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 CA-C-O 126.897 3.237 . . . . 0.0 106.514 176.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.3 t -88.46 171.59 9.99 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 110.235 -3.166 . . . . 0.0 103.677 172.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.26 -34.61 15.6 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.49 -41.51 73.13 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 3.8 mp -88.74 -39.65 12.72 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.822 0 CA-C-O 122.483 1.135 . . . . 0.0 108.912 -178.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 31.1 mt -60.78 -39.65 89.65 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.139 -174.214 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -63.44 -34.82 78.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -89.95 -8.06 52.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.24 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -125.92 37.83 4.27 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.428 0.632 . . . . 0.0 110.711 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 3.6 p -61.1 -28.11 68.85 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -178.084 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.57 -30.46 71.57 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.426 0.631 . . . . 0.0 112.136 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 34.0 t -74.24 -42.94 50.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.7 t -61.94 -37.75 79.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.86 -37.76 88.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.734 177.154 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 95.6 m -71.23 -39.31 71.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 70.0 mt -59.67 -35.75 75.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.199 0.523 . . . . 0.0 110.362 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -65.2 -29.09 69.87 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.947 -0.471 . . . . 0.0 111.254 175.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -72.18 -45.62 59.65 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 122.098 -0.376 . . . . 0.0 111.349 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 17.1 pt -78.79 -18.1 13.3 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.864 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -176.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.455 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.79 -15.93 59.94 Favored 'General case' 0 C--O 1.212 -0.899 0 O-C-N 121.965 -0.459 . . . . 0.0 111.503 176.287 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -118.72 17.94 13.47 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 122.774 0.429 . . . . 0.0 111.241 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 14.7 t80 -63.02 123.65 19.11 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.667 0.387 . . . . 0.0 110.207 -178.346 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -92.4 -21.92 19.94 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 -175.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.89 -41.61 91.31 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.265 0.555 . . . . 0.0 110.589 -177.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -130.26 115.55 17.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.025 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.6 tptt -55.76 -47.95 76.13 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.222 177.785 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -54.99 -42.81 72.95 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -175.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.7 t -56.68 -45.08 82.57 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 O-C-N 122.016 -0.428 . . . . 0.0 109.887 177.164 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.4 ttp -65.04 -43.79 91.19 Favored 'General case' 0 CA--C 1.51 -0.59 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.56 -48.6 76.78 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 44.0 tptt -71.0 -38.36 72.66 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.282 -178.085 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.52 -39.96 85.58 Favored 'General case' 0 CA--C 1.501 -0.926 0 CA-C-O 121.625 0.726 . . . . 0.0 109.044 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.455 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.89 -49.04 76.4 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.535 -1.211 . . . . 0.0 113.052 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.81 -41.35 91.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 51.2 t -70.45 -51.99 33.13 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.021 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.676 -177.562 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -54.59 -45.05 73.51 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.633 0.254 . . . . 0.0 110.317 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 20.5 m -65.93 -36.03 82.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.886 0.374 . . . . 0.0 111.248 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -59.37 -30.74 68.62 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.038 -0.413 . . . . 0.0 110.26 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 6.3 mt -76.63 -32.81 58.26 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 -176.628 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.71 -30.22 71.35 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.67 179.46 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 36.2 m -75.13 -16.47 60.53 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.706 176.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -100.79 -23.72 14.54 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 178.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -177.56 173.64 46.29 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 121.251 -0.499 . . . . 0.0 112.773 -178.012 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 C--O 1.251 1.135 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -176.933 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 118.95 -0.547 . . . . 0.0 109.574 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -133.78 33.67 3.45 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 14.8 m -76.75 139.94 67.04 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.91 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.84 150.63 73.82 Favored 'Trans proline' 0 C--O 1.24 0.62 0 C-N-CA 117.289 -1.34 . . . . 0.0 113.129 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.3 m -69.25 163.2 25.54 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.798 -178.874 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 44.0 t -54.8 -46.9 75.04 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 179.478 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.24 -34.35 76.34 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -178.454 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -67.91 -41.2 83.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.579 1.181 . . . . 0.0 108.184 179.698 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -72.9 -35.31 67.06 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.569 -177.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 3.8 tt -57.92 -36.66 72.8 Favored 'General case' 0 C--O 1.211 -0.933 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.361 178.464 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -57.32 -42.42 81.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.835 0.743 . . . . 0.0 110.124 177.909 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -67.44 -54.33 21.23 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.645 178.118 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -58.27 -44.85 88.62 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -178.465 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.6 t-160 -57.79 -44.5 86.31 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -179.89 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.2 m -62.84 -39.3 93.94 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.623 0.231 . . . . 0.0 111.623 -179.03 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -63.98 -37.53 87.77 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.396 178.507 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.4 mt -58.99 -43.53 89.08 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 178.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -64.01 -44.06 93.76 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 122.082 -0.386 . . . . 0.0 112.003 -178.875 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -65.83 -32.8 74.52 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.75 -178.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.89 -16.67 64.19 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 179.224 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 35.2 mt -110.51 12.21 22.91 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -177.224 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 50.0 mttt -55.26 132.65 48.32 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.255 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.9 t -64.17 -41.71 93.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 122.343 1.068 . . . . 0.0 108.484 176.808 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -68.14 -29.75 68.71 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 113.574 -1.648 . . . . 0.0 113.281 -178.417 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 10.8 t -160.69 75.99 2.65 Favored Pre-proline 0 N--CA 1.469 0.513 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -175.662 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.36 145.87 30.75 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 117.203 -1.398 . . . . 0.0 113.206 178.915 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -137.32 100.66 4.3 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.286 0.565 . . . . 0.0 111.092 178.826 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -56.66 -45.36 82.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -179.341 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 10.9 pttt -59.33 -32.53 70.17 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 121.89 0.852 . . . . 0.0 109.605 -176.919 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -70.39 -40.8 73.73 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.417 -1.265 . . . . 0.0 108.816 -176.473 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.81 -48.5 71.5 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 175.887 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.8 mt -56.93 -43.39 81.44 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -176.724 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -65.42 -37.9 88.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.488 0.661 . . . . 0.0 111.745 179.608 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -69.33 -46.67 66.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.721 0.772 . . . . 0.0 109.682 178.363 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -49.39 72.75 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.396 178.938 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -61.46 -34.66 75.83 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -175.238 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -45.71 60.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 176.731 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.93 -33.51 68.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.465 0.65 . . . . 0.0 109.868 -178.691 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.93 -17.87 68.05 Favored Glycine 0 C--O 1.236 0.251 0 CA-C-O 119.206 -0.775 . . . . 0.0 114.852 179.423 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.7 t -112.53 -6.23 13.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.345 1.073 . . . . 0.0 110.894 -179.733 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.0 mt -72.49 150.16 43.5 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.05 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -78.84 84.46 4.89 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-O 122.671 1.224 . . . . 0.0 109.213 178.145 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.1 m -98.63 50.72 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-O 123.536 1.636 . . . . 0.0 109.115 -177.379 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 3.7 t -64.51 167.83 6.62 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 -179.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.7 m -49.25 -32.16 10.16 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -176.185 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -55.38 -44.7 76.31 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 178.28 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.0 mp -85.97 -43.46 16.46 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-O 121.961 0.886 . . . . 0.0 108.887 179.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.13 -39.91 79.91 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -175.182 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -72.7 -28.51 62.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.346 -176.767 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -88.99 -8.25 54.45 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.862 176.709 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -125.1 40.97 3.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.631 0.729 . . . . 0.0 111.735 -179.066 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 10.7 p -62.75 -24.48 67.72 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -179.103 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.62 -30.86 71.92 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.45 0.643 . . . . 0.0 112.037 177.954 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 22.6 t -71.87 -41.34 69.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.89 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 29.9 t -63.22 -37.98 80.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.681 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.93 -32.59 74.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.653 177.737 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.4 m -79.49 -40.22 30.24 Favored 'General case' 0 C--O 1.217 -0.632 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 38.7 mt -57.61 -35.41 70.42 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.114 0.483 . . . . 0.0 111.039 178.57 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -63.97 -29.05 70.24 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.07 -0.394 . . . . 0.0 111.533 175.175 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -74.13 -45.42 48.98 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.272 -0.268 . . . . 0.0 111.547 178.655 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -77.53 -21.23 14.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.932 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 -176.427 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.422 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -61.56 -18.87 61.12 Favored 'General case' 0 C--O 1.211 -0.959 0 O-C-N 121.961 -0.462 . . . . 0.0 111.658 176.056 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.75 19.44 13.15 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.154 0.582 . . . . 0.0 111.965 177.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -59.97 123.32 16.72 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.136 0.493 . . . . 0.0 111.629 -177.805 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -81.79 -28.46 33.18 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -176.744 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -69.17 -38.81 78.9 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -174.721 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -135.05 121.38 20.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.768 0.318 . . . . 0.0 110.765 -177.937 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.7 tptt -64.17 -40.32 95.87 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 178.221 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -46.97 73.88 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 123.341 0.656 . . . . 0.0 111.467 -176.525 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.0 t -58.73 -44.75 90.74 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.904 178.331 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -62.11 -44.2 97.16 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.97 -47.45 77.53 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.419 -0.512 . . . . 0.0 112.229 179.814 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -70.18 -38.21 75.34 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 118.408 -1.317 . . . . 0.0 111.285 -178.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.4 -39.73 84.34 Favored 'General case' 0 C--O 1.213 -0.832 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.365 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.422 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.91 -48.93 72.4 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.813 -1.085 . . . . 0.0 113.036 178.756 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -41.62 89.55 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.84 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.9 t -70.52 -50.33 46.08 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.013 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.937 -178.276 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -55.49 -44.74 76.81 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 -178.211 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.1 m -66.63 -35.57 80.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.263 0.554 . . . . 0.0 111.131 179.184 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 15.5 mtt85 -61.2 -29.43 69.81 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.879 -0.513 . . . . 0.0 109.99 175.217 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 8.8 mt -76.6 -36.03 57.76 Favored 'General case' 0 C--O 1.205 -1.268 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -177.555 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -30.1 70.24 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.588 178.931 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.4 m -75.7 -8.55 57.11 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.108 178.483 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 67.3 mtt85 -118.28 -23.28 7.34 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -179.945 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . 172.83 147.82 6.01 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 115.183 0.833 . . . . 0.0 115.183 178.974 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 3.7 m . . . . . 0 C--O 1.254 1.326 0 N-CA-C 115.64 1.719 . . . . 0.0 115.64 177.476 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -70.7 164.48 24.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 176.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.0 m -145.44 152.24 49.27 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 178.048 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -67.57 151.49 79.49 Favored 'Trans proline' 0 C--O 1.244 0.781 0 C-N-CA 118.204 -0.73 . . . . 0.0 113.787 -179.04 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.4 m -69.8 168.82 14.29 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.86 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.0 t -56.09 -47.93 79.74 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.929 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -179.749 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -64.94 -34.26 78.0 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -178.57 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -66.49 -43.59 84.98 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.024 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 19.7 mttt -69.37 -33.75 73.53 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.368 -178.02 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -56.71 -38.88 72.93 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.607 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.98 -40.22 69.84 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.992 -178.862 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -67.02 -55.06 16.0 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 176.89 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -46.14 90.63 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -176.712 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -61.45 -39.5 91.05 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.644 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 65.2 m -65.11 -41.17 95.17 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.556 179.164 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.13 -42.64 99.56 Favored 'General case' 0 CA--C 1.501 -0.934 0 C-N-CA 120.976 -0.289 . . . . 0.0 111.19 178.388 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -54.65 -46.64 73.16 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.269 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.683 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 43.6 mtpt -67.81 -38.85 83.81 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -177.425 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -67.32 -32.92 74.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.895 0.379 . . . . 0.0 110.198 178.099 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.0 -19.68 66.12 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 178.955 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 25.4 mt -105.22 12.16 32.21 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.386 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 29.4 mtpt -55.66 130.38 42.92 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.564 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 44.9 t -63.6 -40.51 89.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 122.395 1.093 . . . . 0.0 108.931 177.992 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -30.44 71.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.568 -1.651 . . . . 0.0 113.016 -178.24 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 2.7 p -163.08 79.66 1.68 Allowed Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.343 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.04 146.28 51.9 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 116.938 -1.575 . . . . 0.0 112.265 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -137.22 92.65 2.73 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.513 0.673 . . . . 0.0 109.921 -175.714 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -58.9 -45.0 92.06 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.798 0 N-CA-C 113.391 0.885 . . . . 0.0 113.391 -177.229 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -57.12 -31.9 65.78 Favored 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -178.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -71.03 -41.47 70.81 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.675 -177.87 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -63.92 -48.61 75.9 Favored 'General case' 0 C--O 1.211 -0.942 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 176.7 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 81.2 mt -57.99 -44.19 87.01 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 117.863 0.301 . . . . 0.0 111.619 -176.935 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.16 -39.07 91.4 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.622 0.725 . . . . 0.0 110.735 178.88 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.82 -49.33 62.83 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.357 0.598 . . . . 0.0 109.796 178.816 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -45.43 83.24 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.52 178.282 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -65.35 -33.31 75.66 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 121.243 -0.91 . . . . 0.0 112.504 -176.848 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -67.8 -49.37 62.71 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 105.307 -2.108 . . . . 0.0 105.307 175.395 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -30.63 33.53 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.54 0.686 . . . . 0.0 111.119 -177.64 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -62.97 -28.36 71.88 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 114.894 0.718 . . . . 0.0 114.894 178.163 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 8.0 t -100.86 -26.36 13.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 117.745 0.773 . . . . 0.0 110.808 -179.342 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.0 mp -55.46 136.01 50.04 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 176.362 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -78.81 84.37 4.87 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-O 122.975 1.369 . . . . 0.0 110.416 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.4 m -95.7 48.5 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.325 0 CA-C-O 122.963 1.363 . . . . 0.0 108.734 -178.988 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 8.9 t -66.92 171.64 5.21 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 -178.219 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.23 -30.74 7.52 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -174.369 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -55.48 -46.55 76.87 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.391 -0.193 . . . . 0.0 111.519 177.052 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -87.12 -41.05 14.42 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 CA-C-O 121.511 0.672 . . . . 0.0 109.695 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.7 -36.18 76.0 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -174.894 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -65.4 -32.27 73.81 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.755 0.788 . . . . 0.0 111.722 -178.679 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -95.76 -0.33 51.49 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.801 -179.229 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -133.01 42.59 3.04 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.568 0.699 . . . . 0.0 111.613 179.175 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.2 p -64.14 -27.21 68.93 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -179.122 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -65.04 -24.43 67.48 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.654 0.74 . . . . 0.0 111.938 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 55.4 t -70.55 -43.53 77.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 179.173 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 28.8 t -64.21 -36.17 76.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.238 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.26 -38.27 88.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.813 177.325 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.4 m -76.08 -38.6 56.84 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 118.874 0.761 . . . . 0.0 109.861 -179.551 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 49.5 mt -58.15 -35.19 71.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.02 0.438 . . . . 0.0 111.226 178.639 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -64.46 -29.18 70.23 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.993 -0.442 . . . . 0.0 111.465 175.129 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -73.04 -46.31 52.54 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 117.767 0.258 . . . . 0.0 111.423 178.845 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -77.21 -20.52 14.3 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -176.106 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -62.44 -15.82 51.63 Favored 'General case' 0 C--O 1.212 -0.885 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 177.259 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 11.6 ptp85 -118.69 19.34 13.23 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.031 0.533 . . . . 0.0 111.458 175.891 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -64.07 105.69 0.92 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -175.72 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -70.09 -30.14 67.29 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -176.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.74 -27.5 66.85 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -174.637 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -147.69 113.74 5.82 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.096 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 41.8 tptt -56.71 -45.46 81.87 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.531 -178.294 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -56.48 -40.68 75.32 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.987 0.422 . . . . 0.0 112.003 -175.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -56.84 -45.1 83.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 177.384 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -64.84 -43.41 93.14 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 119.192 -0.432 . . . . 0.0 110.241 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.48 -48.17 76.2 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.409 -0.517 . . . . 0.0 112.005 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 31.4 tptt -68.62 -39.48 80.78 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.071 -178.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.63 -40.82 84.46 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-O 121.306 0.574 . . . . 0.0 109.518 177.827 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.5 -48.27 75.78 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.247 -0.888 . . . . 0.0 113.296 179.433 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -42.24 93.67 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.1 t -70.65 -50.09 47.09 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.8 -178.579 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -54.79 -45.46 74.33 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.733 0.301 . . . . 0.0 110.193 -177.351 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.6 m -66.82 -33.97 76.77 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.397 0.617 . . . . 0.0 111.312 179.916 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 13.1 mtt85 -61.35 -29.81 70.13 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 121.796 -0.565 . . . . 0.0 109.96 174.885 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 9.0 mt -76.52 -34.01 58.58 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -175.208 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . 0.449 ' HA ' ' HZ2' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -63.29 -27.87 69.63 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.961 178.08 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.7 m -81.44 -8.66 59.76 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.607 -1.179 . . . . 0.0 112.075 177.505 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 69.4 mtt85 -114.15 -22.74 9.85 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 179.536 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -165.82 164.53 37.46 Favored Glycine 0 N--CA 1.453 -0.214 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -178.633 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 10.6 m . . . . . 0 C--O 1.242 0.702 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -176.838 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 118.783 -0.627 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -66.22 -36.58 83.43 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 177.168 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 17.4 m -84.32 135.43 41.47 Favored Pre-proline 0 C--N 1.324 -0.53 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 176.087 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.19 152.68 62.02 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 118.224 -0.717 . . . . 0.0 113.234 179.211 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.8 m -73.21 162.88 28.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.777 -178.709 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 56.0 t -54.61 -47.18 72.71 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.792 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.681 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -65.07 -33.78 76.86 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -178.53 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.11 -41.74 85.72 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.97 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -72.43 -32.73 66.55 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.863 -177.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -57.42 -39.17 75.64 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.306 -179.541 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -53.76 -38.84 64.82 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.969 -178.878 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -70.42 -55.38 9.19 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.444 176.424 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.9 -45.89 82.31 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -176.397 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 17.9 t-160 -62.02 -38.79 90.0 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.477 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 52.0 m -65.39 -41.31 93.81 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.357 178.696 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -63.81 -42.41 97.68 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 117.938 0.336 . . . . 0.0 111.255 178.742 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.52 -46.74 71.73 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 177.329 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 50.1 mtpt -68.14 -38.63 82.39 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.163 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -66.58 -32.68 74.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 177.934 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.78 -19.41 65.88 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 178.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 21.6 mt -104.11 12.1 34.36 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -56.47 129.44 40.73 Favored 'General case' 0 C--O 1.208 -1.114 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 178.126 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 57.0 t -62.41 -39.84 85.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 122.44 1.114 . . . . 0.0 108.242 177.229 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.36 -28.75 69.5 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 113.272 -1.786 . . . . 0.0 113.165 -179.506 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 95.9 p -163.03 76.68 1.87 Allowed Pre-proline 0 C--O 1.241 0.627 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.017 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.82 144.97 49.78 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 114.701 -3.066 . . . . 0.0 111.895 179.469 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -137.21 91.53 2.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.755 0.788 . . . . 0.0 110.228 -174.851 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -57.29 -45.65 85.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -177.636 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.72 -30.47 68.84 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -178.0 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -71.01 -41.64 70.65 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -178.501 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.23 -48.31 76.32 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.458 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 94.0 mt -57.64 -42.55 83.65 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 117.627 0.194 . . . . 0.0 111.464 -177.343 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -64.8 -39.1 93.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.3 0.572 . . . . 0.0 111.25 178.382 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -65.82 -48.67 70.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 177.995 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.53 -44.57 89.62 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.505 178.822 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.27 -33.18 75.22 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 119.086 0.857 . . . . 0.0 111.544 -177.085 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -50.85 37.52 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 106.074 -1.825 . . . . 0.0 106.074 175.065 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.27 -30.72 18.74 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.211 0.529 . . . . 0.0 112.308 -177.479 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.64 -28.03 73.21 Favored Glycine 0 C--O 1.24 0.501 0 N-CA-C 114.91 0.724 . . . . 0.0 114.91 177.608 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 9.0 t -100.36 -25.94 14.05 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.322 0.561 . . . . 0.0 110.67 -177.844 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.0 mp -56.11 137.11 52.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 O-C-N 121.789 -0.569 . . . . 0.0 112.389 174.825 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -78.97 80.23 5.33 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 122.588 1.185 . . . . 0.0 109.795 -179.422 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 30.9 m -93.33 49.76 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 CA-C-O 123.248 1.499 . . . . 0.0 108.081 -179.731 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.6 t -66.96 174.95 2.72 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 113.859 -1.518 . . . . 0.0 107.122 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 21.0 m -49.29 -36.16 20.05 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -173.577 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -53.72 -44.54 69.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 178.42 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -88.57 -40.29 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 -179.33 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -39.81 81.89 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -176.261 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -68.89 -31.09 69.76 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.757 -0.202 . . . . 0.0 111.358 -178.375 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -90.04 -2.38 58.11 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 122.235 -0.291 . . . . 0.0 111.328 177.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -129.91 46.51 2.64 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.698 0.761 . . . . 0.0 111.802 179.046 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.2 p -64.6 -28.83 69.89 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 121.713 -0.617 . . . . 0.0 112.307 -179.29 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -65.41 -28.56 69.34 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.393 0.616 . . . . 0.0 111.715 177.851 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 59.5 t -68.9 -44.52 81.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.782 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 34.4 t -62.56 -36.36 74.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.211 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.6 -40.1 95.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 119.345 -0.36 . . . . 0.0 110.7 177.309 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 93.6 m -72.77 -39.71 66.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 118.704 0.684 . . . . 0.0 110.532 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 68.9 mt -57.76 -35.02 70.19 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.903 0.382 . . . . 0.0 111.133 178.828 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -65.41 -29.05 69.71 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.691 -0.631 . . . . 0.0 111.527 175.928 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -73.05 -46.03 54.09 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.022 0.439 . . . . 0.0 110.798 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 15.2 pt -77.39 -21.44 14.19 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 -175.843 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.457 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -62.49 -18.86 62.81 Favored 'General case' 0 C--O 1.212 -0.888 0 O-C-N 121.94 -0.475 . . . . 0.0 111.422 175.89 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.77 18.98 13.27 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 122.846 0.458 . . . . 0.0 111.101 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -63.04 119.95 10.47 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 122.612 0.365 . . . . 0.0 110.69 -178.479 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -88.45 -23.29 23.31 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 115.437 1.643 . . . . 0.0 115.437 -175.598 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.01 -41.22 91.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.245 0.545 . . . . 0.0 110.993 -177.641 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -130.8 112.64 13.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.91 -179.048 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -56.78 -43.65 81.06 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.889 179.086 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -55.79 -41.86 74.72 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -176.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.2 t -58.19 -43.33 85.45 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.092 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -64.17 -44.03 93.32 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 179.786 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -63.56 -48.91 75.52 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.958 -179.606 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -70.54 -39.04 74.23 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 118.717 -1.193 . . . . 0.0 111.132 -177.516 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.43 -39.56 83.93 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 121.355 0.598 . . . . 0.0 109.789 178.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.457 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.58 -46.2 83.74 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.28 -0.873 . . . . 0.0 113.172 178.745 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -40.42 90.67 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.006 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 55.6 t -70.68 -53.62 21.45 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.359 -178.793 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -53.94 -44.94 71.09 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 122.293 0.237 . . . . 0.0 110.734 -175.027 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 28.0 m -64.2 -38.79 92.33 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 123.203 0.601 . . . . 0.0 111.125 179.136 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 40.6 mtt85 -61.91 -30.65 71.04 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 121.748 -0.595 . . . . 0.0 110.909 176.923 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 5.8 mt -75.6 -31.73 60.05 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 -177.149 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -36.57 78.72 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.974 176.014 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.4 m -81.73 -15.05 55.6 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 177.02 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 90.2 mtt-85 -91.98 -18.39 23.74 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.916 -0.49 . . . . 0.0 111.761 -179.852 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -123.16 -172.35 13.83 Favored Glycine 0 C--O 1.226 -0.404 0 N-CA-C 109.876 -1.29 . . . . 0.0 109.876 -178.0 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.246 0.871 0 C-N-CA 124.548 1.139 . . . . 0.0 108.699 -177.383 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -74.29 166.07 24.09 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 177.29 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 22.9 t -144.71 142.37 18.91 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 177.662 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -67.46 152.74 78.27 Favored 'Trans proline' 0 C--O 1.241 0.632 0 C-N-CA 117.983 -0.878 . . . . 0.0 113.4 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.6 m -67.09 166.18 14.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.478 179.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.2 t -55.43 -46.17 78.53 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.047 0 O-C-N 122.212 -0.305 . . . . 0.0 111.543 179.095 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.69 -35.25 80.43 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -177.529 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.56 -42.08 87.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.84 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -69.22 -38.12 78.38 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 121.546 0.688 . . . . 0.0 109.503 -179.154 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 4.5 tt -57.73 -35.58 70.88 Favored 'General case' 0 C--O 1.209 -1.045 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.727 179.424 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -57.58 -41.31 80.89 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 119.366 0.984 . . . . 0.0 110.402 178.066 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -67.39 -53.22 31.19 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.721 178.427 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -45.22 88.81 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.892 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.0 t-160 -58.17 -44.8 88.15 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.1 m -62.69 -39.07 92.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 -179.125 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 13.3 mm-40 -64.11 -37.62 88.12 Favored 'General case' 0 CA--C 1.505 -0.764 0 C-N-CA 120.516 -0.473 . . . . 0.0 110.49 178.346 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.4 mt -59.09 -43.39 89.1 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.954 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 178.845 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -63.04 -45.32 92.81 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 122.127 -0.358 . . . . 0.0 111.855 -179.485 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -65.71 -33.24 75.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.734 0.302 . . . . 0.0 111.121 -178.524 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.15 -15.99 64.05 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 179.37 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 36.0 mt -111.87 12.1 20.82 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -177.914 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt -54.23 129.48 35.22 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 177.434 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.39 -40.33 83.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 122.73 1.253 . . . . 0.0 107.893 177.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.84 -24.63 64.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 112.959 -1.928 . . . . 0.0 113.348 179.944 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 7.1 m -159.58 71.74 3.3 Favored Pre-proline 0 N--CA 1.475 0.788 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -176.778 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -71.49 139.82 35.2 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 114.142 -3.438 . . . . 0.0 112.006 179.144 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -137.14 95.85 3.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.529 0.681 . . . . 0.0 111.583 -177.649 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -55.12 -48.88 75.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -176.871 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 19.8 pttm -58.61 -32.55 69.11 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-O 122.533 1.159 . . . . 0.0 110.503 -175.566 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -67.86 -42.17 81.75 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.194 -178.144 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.8 -48.34 74.79 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.733 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 75.5 mt -56.76 -43.19 80.55 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -176.125 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -64.64 -38.77 92.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.639 0.733 . . . . 0.0 111.95 179.384 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -69.85 -44.87 69.0 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.468 0.652 . . . . 0.0 109.551 179.333 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.05 -49.8 72.73 Favored 'General case' 0 N--CA 1.428 -1.564 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.463 177.224 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -62.4 -34.86 77.56 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -175.376 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -67.8 -48.22 66.88 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 176.367 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -32.21 66.46 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.291 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.6 -15.66 66.64 Favored Glycine 0 N--CA 1.453 -0.222 0 CA-C-O 119.104 -0.831 . . . . 0.0 114.382 179.129 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.5 t -114.54 -13.72 12.16 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.482 1.141 . . . . 0.0 110.968 179.518 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.0 mt -67.29 148.25 51.93 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.818 -0.551 . . . . 0.0 110.558 179.472 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -77.83 84.41 4.14 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 122.738 1.256 . . . . 0.0 109.936 178.261 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.8 m -98.35 50.11 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-O 123.228 1.489 . . . . 0.0 109.138 -177.597 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.1 t -68.58 171.89 6.97 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 106.567 -1.642 . . . . 0.0 106.567 -179.195 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.28 -33.49 13.14 Favored 'General case' 0 C--O 1.218 -0.596 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -174.109 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -54.19 -44.39 71.51 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 111.441 0.163 . . . . 0.0 111.441 178.378 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.5 mp -88.52 -43.13 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-O 121.337 0.589 . . . . 0.0 110.088 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -40.37 84.26 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -175.527 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -71.14 -28.64 64.43 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.136 -176.35 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -89.76 -5.55 56.85 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 122.332 -0.23 . . . . 0.0 111.169 176.903 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -127.44 42.55 3.3 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.854 0.835 . . . . 0.0 112.505 179.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 17.8 p -63.86 -24.01 67.58 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -179.264 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.54 -32.27 73.85 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.314 1.054 . . . . 0.0 112.213 178.293 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.3 t -69.6 -42.58 80.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 179.118 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 48.5 t -63.2 -37.47 79.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.079 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.41 -33.13 74.88 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.655 178.029 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.7 m -79.29 -39.38 33.08 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.904 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 40.7 mt -57.43 -34.7 69.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.985 0.421 . . . . 0.0 111.431 178.22 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -63.87 -29.2 70.41 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.781 -0.574 . . . . 0.0 111.568 175.157 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -74.77 -43.34 55.33 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.603 0.239 . . . . 0.0 111.611 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -78.78 -21.82 12.93 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.952 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -177.373 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -60.65 -17.91 50.3 Favored 'General case' 0 C--O 1.211 -0.924 0 O-C-N 122.032 -0.417 . . . . 0.0 112.091 176.357 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -118.71 19.35 13.21 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.053 0.541 . . . . 0.0 111.269 178.005 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -65.7 115.34 5.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.167 0.508 . . . . 0.0 111.46 -176.968 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -82.91 -23.6 33.46 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 -176.488 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.54 -40.33 92.78 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.972 -177.093 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -133.22 113.23 12.43 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.87 -178.773 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.1 tptt -56.05 -44.66 79.06 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.565 178.728 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -55.32 -43.15 74.65 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -176.731 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 76.0 t -57.91 -43.93 85.56 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 177.477 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -62.97 -44.69 95.36 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 119.333 -0.365 . . . . 0.0 110.04 179.414 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.91 -47.51 77.5 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.5 tptt -69.33 -39.24 78.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.115 -1.034 . . . . 0.0 111.28 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.92 85.94 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.263 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.421 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.73 -48.82 75.47 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.774 -1.103 . . . . 0.0 113.142 178.863 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -43.32 92.6 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.841 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 78.8 t -68.94 -50.55 53.06 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.877 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.162 -178.416 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -55.03 -43.86 74.09 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.611 0.243 . . . . 0.0 110.446 -177.692 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 16.5 m -67.57 -35.82 79.74 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 122.641 0.377 . . . . 0.0 111.123 179.265 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.52 -31.85 69.77 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 176.182 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 5.5 mt -75.08 -36.73 61.72 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -176.327 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . 0.407 ' HZ2' ' C ' ' A' ' 551' ' ' SER . 7.0 mmpt? -56.45 -37.68 70.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.629 179.429 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 13.8 m -75.12 -8.5 56.75 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 178.421 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -114.6 -30.04 6.63 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -176.858 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -162.47 35.13 0.34 Allowed Glycine 0 C--O 1.233 0.08 0 C-N-CA 120.893 -0.67 . . . . 0.0 114.017 -178.978 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 551' ' ' SER . . . . . 0.407 ' C ' ' HZ2' ' A' ' 547' ' ' LYS . 29.8 m . . . . . 0 C--O 1.25 1.091 0 C-N-CA 123.72 0.808 . . . . 0.0 111.686 -177.239 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -73.26 162.57 29.22 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 176.873 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 22.7 m -73.79 138.63 76.76 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.677 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.83 148.74 58.8 Favored 'Trans proline' 0 C--O 1.239 0.541 0 C-N-CA 117.742 -1.039 . . . . 0.0 113.645 -179.413 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.4 m -68.54 164.28 21.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.784 179.46 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 32.7 t -53.89 -47.6 63.92 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 O-C-N 122.007 -0.433 . . . . 0.0 111.97 179.399 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.2 pt-20 -62.31 -33.68 75.13 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.428 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -67.28 -40.8 86.16 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -179.565 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -74.21 -35.58 63.92 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.409 -178.034 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 3.7 tt -58.63 -37.2 75.39 Favored 'General case' 0 C--O 1.206 -1.197 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.237 178.369 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -59.07 -40.85 86.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 119.036 0.835 . . . . 0.0 110.61 178.422 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -64.82 -53.13 51.7 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.789 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -44.57 93.89 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.079 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.4 t-160 -57.9 -44.79 86.99 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -178.898 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.7 m -62.77 -39.63 94.8 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.181 0.301 . . . . 0.0 111.622 -179.325 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -64.41 -37.25 86.86 Favored 'General case' 0 CA--C 1.504 -0.81 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.625 178.337 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.8 mt -59.14 -43.47 89.48 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.031 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 178.872 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.7 mmtt -63.68 -46.02 87.43 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.37 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -64.81 -33.04 75.05 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 120.8 0.333 . . . . 0.0 111.16 -178.246 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.59 -17.55 64.67 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 179.958 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.2 mt -111.89 12.05 20.8 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -177.091 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -66.76 133.38 50.02 Favored 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 179.932 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 40.4 t -56.89 -39.14 63.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-O 122.079 0.942 . . . . 0.0 111.326 -177.246 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -63.02 -30.24 71.44 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 113.978 -1.465 . . . . 0.0 113.381 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 2.2 m -164.53 78.62 1.43 Allowed Pre-proline 0 N--CA 1.479 0.986 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.399 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.96 147.52 61.75 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 115.732 -2.379 . . . . 0.0 112.339 177.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -137.3 99.57 4.01 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.672 0.748 . . . . 0.0 110.118 -179.386 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.22 -47.26 84.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.355 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.94 -32.62 67.97 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 121.99 0.9 . . . . 0.0 109.989 -176.74 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -69.52 -41.37 76.09 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.268 -1.333 . . . . 0.0 108.933 -176.543 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.57 -49.81 67.48 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 176.096 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 81.2 mt -56.45 -43.07 79.16 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.286 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.35 -38.27 90.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.64 0.733 . . . . 0.0 112.07 -179.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -72.1 -44.81 62.64 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.722 -0.612 . . . . 0.0 109.642 178.449 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -48.09 72.55 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.542 177.205 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -62.55 -35.76 80.48 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -176.17 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -67.84 -48.97 64.69 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.395 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.66 -33.63 64.25 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.88 -179.526 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.71 -17.77 69.49 Favored Glycine 0 C--O 1.236 0.276 0 N-CA-C 115.165 0.826 . . . . 0.0 115.165 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.9 t -111.08 -12.77 14.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.064 0.932 . . . . 0.0 110.484 -179.584 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 5.2 mt -67.71 148.15 51.69 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.979 -0.451 . . . . 0.0 110.462 -179.884 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 37.4 tt0 -78.59 84.46 4.71 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-O 122.841 1.305 . . . . 0.0 109.078 177.655 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 30.3 m -99.97 48.37 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 CA-C-O 123.087 1.422 . . . . 0.0 108.477 -177.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.4 t -67.06 172.45 4.55 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 -179.602 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 24.1 m -49.23 -32.19 10.14 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -174.419 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -54.48 -44.95 73.08 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 178.169 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.4 mp -88.68 -42.6 14.79 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 CA-C-O 121.261 0.553 . . . . 0.0 109.656 179.388 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.85 -40.07 83.16 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 -175.196 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -70.53 -28.95 65.33 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.192 -176.875 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -90.54 -4.25 57.03 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 122.364 -0.21 . . . . 0.0 111.171 177.23 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -128.24 43.02 3.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.674 0.75 . . . . 0.0 112.361 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.7 p -63.44 -24.34 67.79 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -178.833 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.64 -30.61 71.34 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.527 0.679 . . . . 0.0 112.158 178.077 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 42.7 t -71.18 -41.55 75.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 107.262 -1.385 . . . . 0.0 107.262 178.402 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 38.1 t -62.99 -37.67 79.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.616 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.08 -34.52 78.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.447 177.7 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.7 m -77.1 -39.76 48.39 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.668 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 47.0 mt -58.36 -35.52 72.08 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.261 0.553 . . . . 0.0 110.933 178.87 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.56 -29.08 70.1 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.998 -0.439 . . . . 0.0 111.343 175.246 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -72.91 -45.33 58.73 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 117.839 0.29 . . . . 0.0 111.472 178.391 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -77.66 -21.68 13.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -176.215 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.424 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.2 OUTLIER -61.19 -18.32 57.65 Favored 'General case' 0 C--O 1.211 -0.958 0 O-C-N 122.132 -0.355 . . . . 0.0 111.895 176.452 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -118.74 19.45 13.16 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.025 0.53 . . . . 0.0 112.042 176.537 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.2 t80 -60.96 118.18 6.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.236 0.541 . . . . 0.0 112.24 -177.263 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -74.04 -33.18 63.64 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 -176.672 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.01 -41.9 85.86 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -172.975 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -131.91 117.2 18.16 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 122.314 -0.241 . . . . 0.0 110.867 -177.811 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.4 tptt -57.7 -46.63 84.08 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.517 178.165 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -55.64 -42.66 75.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -176.383 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 72.2 t -56.73 -44.47 81.6 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.521 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 177.242 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.9 ttp -64.29 -43.86 93.45 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 119.151 -0.452 . . . . 0.0 110.036 179.435 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -64.7 -47.32 78.78 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.377 -0.529 . . . . 0.0 112.092 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -69.65 -39.14 77.25 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 119.148 -1.021 . . . . 0.0 111.104 -179.138 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.1 -39.92 83.71 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.414 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.88 -49.54 70.08 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.922 -1.036 . . . . 0.0 113.18 179.081 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -42.6 91.25 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.983 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.8 t -70.6 -50.09 47.42 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.464 -177.93 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -55.35 -45.11 76.46 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -177.999 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.6 m -66.75 -34.77 78.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.399 0.618 . . . . 0.0 111.186 179.55 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 12.3 mtt85 -60.71 -29.77 69.54 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.864 -0.522 . . . . 0.0 109.967 175.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 8.8 mt -76.52 -35.3 58.39 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -176.134 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . 0.414 ' HA ' ' HZ2' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -62.81 -28.93 70.34 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.03 178.902 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 22.1 m -78.7 -8.59 58.85 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.718 -1.128 . . . . 0.0 111.905 178.385 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -115.4 -26.65 7.48 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.44 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -164.57 161.78 34.88 Favored Glycine 0 C--O 1.237 0.287 0 C-N-CA 121.522 -0.371 . . . . 0.0 112.443 -177.974 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 12.6 m . . . . . 0 C--O 1.241 0.655 0 CA-C-O 117.758 -1.115 . . . . 0.0 112.642 -177.909 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.955 0 CA-C-O 118.621 -0.704 . . . . 0.0 109.815 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 68.4 -38.64 0.38 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 125.53 1.532 . . . . 0.0 112.738 -175.704 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 53.3 m -140.4 154.44 69.6 Favored Pre-proline 0 C--O 1.243 0.735 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 174.133 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -72.26 152.6 55.92 Favored 'Trans proline' 0 C--O 1.243 0.729 0 O-C-N 122.212 0.585 . . . . 0.0 113.561 179.259 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.5 m -72.13 168.94 17.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.263 179.305 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 56.7 t -57.37 -46.41 85.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.022 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.432 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -65.49 -34.16 77.63 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.572 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -65.24 -42.86 92.92 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 177.393 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -70.05 -34.61 73.45 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.041 -179.201 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -57.55 -40.43 78.88 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.356 -178.552 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -55.01 -40.09 69.77 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.579 -179.213 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 53.3 tttt -67.94 -57.77 5.64 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.503 -0.184 . . . . 0.0 110.503 176.744 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -45.52 89.02 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -176.126 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -60.0 -42.28 93.92 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -179.325 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 61.8 m -62.64 -39.67 94.6 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.998 -179.218 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.6 mm-40 -63.72 -37.85 88.89 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.077 178.431 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -60.08 -42.53 90.24 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.022 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.368 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -64.81 -45.12 87.6 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 122.182 -0.324 . . . . 0.0 111.568 -179.452 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -66.2 -30.44 70.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.192 -178.185 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.73 -18.19 64.81 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 178.604 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 35.2 mt -107.66 12.21 27.76 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -177.985 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -55.23 135.87 49.25 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-O 121.697 0.761 . . . . 0.0 109.914 178.124 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 13.0 m -73.49 -21.45 18.63 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.149 178.877 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.58 -31.18 47.11 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 113.798 -1.546 . . . . 0.0 111.251 -178.873 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 43.5 t -168.8 83.41 0.69 Allowed Pre-proline 0 C--O 1.238 0.483 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.912 -175.831 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.35 146.45 50.66 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 115.447 -2.569 . . . . 0.0 111.964 178.014 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -137.18 100.12 4.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.857 0.837 . . . . 0.0 111.419 -178.839 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -58.85 -44.2 90.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.959 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -60.65 -31.82 71.02 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -177.849 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -71.53 -41.81 68.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.1 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.94 -48.61 75.83 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.407 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 71.4 mt -56.87 -43.88 81.66 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -176.715 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -65.35 -38.72 90.95 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.322 0.582 . . . . 0.0 111.326 -179.658 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.24 -47.13 71.7 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.425 0.631 . . . . 0.0 109.463 178.631 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.09 -42.2 80.27 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.054 178.085 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -62.8 -37.93 88.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 119.094 0.861 . . . . 0.0 112.579 -177.942 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -70.93 -44.09 66.87 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.91 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -32.92 66.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.522 0.677 . . . . 0.0 110.738 179.164 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.53 -16.97 66.13 Favored Glycine 0 C--O 1.239 0.433 0 CA-C-O 119.165 -0.797 . . . . 0.0 114.749 -179.84 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.5 t -113.74 -15.37 12.46 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.15 0.975 . . . . 0.0 111.227 -179.766 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.0 mt -64.94 145.24 56.58 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.98 -0.45 . . . . 0.0 110.813 179.734 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 38.3 tt0 -79.62 84.29 5.49 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 122.531 1.158 . . . . 0.0 109.653 178.168 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 27.0 m -96.44 48.18 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-O 123.214 1.483 . . . . 0.0 108.21 -178.705 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.7 t -68.16 172.99 5.06 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 -178.296 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.6 m -49.29 -31.65 9.41 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -173.643 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -55.43 -44.59 76.44 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 177.015 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.4 mp -88.66 -42.18 14.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.566 0 CA-C-O 121.72 0.772 . . . . 0.0 109.1 -179.279 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -40.5 78.71 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -175.591 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -69.71 -31.3 69.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.15 -177.455 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -89.29 -5.14 57.81 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.233 178.31 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -128.94 45.03 2.86 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.43 0.633 . . . . 0.0 112.19 -179.652 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 25.2 p -65.08 -26.76 68.37 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -179.375 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -63.39 -27.25 69.17 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.918 0.866 . . . . 0.0 111.992 177.799 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 55.0 t -70.65 -45.69 72.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 179.549 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.4 -36.99 78.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 179.052 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.4 -36.36 82.08 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.861 177.42 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 61.4 m -76.26 -40.54 51.63 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 118.182 0.446 . . . . 0.0 110.457 179.445 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 61.4 mt -57.97 -35.12 70.71 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.051 0.453 . . . . 0.0 111.087 178.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -63.86 -29.0 70.23 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.9 -0.5 . . . . 0.0 111.452 175.733 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -73.19 -46.46 50.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.787 0.327 . . . . 0.0 111.31 178.81 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 7.7 pt -77.12 -21.18 14.4 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -175.983 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.439 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.28 -14.7 52.52 Favored 'General case' 0 C--O 1.213 -0.842 0 O-C-N 121.746 -0.596 . . . . 0.0 112.282 175.786 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -118.86 17.78 13.37 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 122.48 0.312 . . . . 0.0 111.233 175.69 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 10.1 t80 -62.88 126.16 26.4 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.957 0.408 . . . . 0.0 110.856 -177.071 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -92.43 -24.95 18.68 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -176.437 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.82 -39.81 94.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.155 0.502 . . . . 0.0 110.965 -176.963 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -133.64 121.09 21.51 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.055 -179.405 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -60.26 -44.02 95.65 Favored 'General case' 0 C--O 1.211 -0.963 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.875 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.69 -43.98 76.92 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -175.401 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.6 t -58.39 -44.65 89.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.136 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.8 ttp -64.94 -43.29 93.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.106 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.43 -48.9 75.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 179.353 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 40.2 tptt -71.66 -37.72 70.76 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 118.493 -1.283 . . . . 0.0 111.19 -177.518 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.2 -40.73 82.33 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-O 121.785 0.802 . . . . 0.0 108.952 178.363 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.439 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.75 -50.81 69.6 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.219 -1.355 . . . . 0.0 113.84 178.756 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.47 -43.67 89.01 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 -179.381 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.21 -52.62 41.01 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -177.134 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -53.98 -44.05 70.48 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.598 0.359 . . . . 0.0 110.551 -177.416 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 50.8 m -64.07 -38.52 91.37 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 123.844 0.858 . . . . 0.0 111.681 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -64.41 -28.5 69.72 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 121.552 -0.717 . . . . 0.0 110.781 176.734 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 7.2 mt -74.39 -35.62 63.49 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.027 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -57.72 -39.48 77.37 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.165 177.413 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 22.9 t -73.02 -17.23 61.47 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 178.947 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 73.1 mtt85 -98.62 -12.38 21.17 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.929 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -160.4 -87.89 0.07 OUTLIER Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.403 -177.18 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 C--O 1.25 1.106 0 N-CA-C 105.178 -2.156 . . . . 0.0 105.178 -178.96 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.899 0 CA-C-O 118.564 -0.731 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -67.21 -36.62 82.09 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 175.975 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 19.8 m -91.85 149.33 38.82 Favored Pre-proline 0 C--O 1.243 0.759 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 175.044 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.44 147.56 71.45 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 118.091 -0.806 . . . . 0.0 113.37 179.42 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 7.1 m -72.79 167.45 20.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.26 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -54.79 -45.83 74.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 O-C-N 121.894 -0.504 . . . . 0.0 111.578 179.516 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.48 -31.58 72.34 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.021 -178.854 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -73.5 -42.14 62.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 122.138 0.97 . . . . 0.0 108.405 179.384 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -70.33 -32.71 70.56 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.379 -177.628 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -55.05 -40.21 70.04 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.358 178.842 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -54.23 -40.6 67.85 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.686 -178.268 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -69.54 -53.2 20.14 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.314 177.75 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -46.86 86.56 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -178.742 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -60.25 -43.67 95.91 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -179.465 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 69.0 m -60.24 -38.71 84.28 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 118.01 0.368 . . . . 0.0 111.124 -179.83 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -65.71 -36.34 83.34 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 120.159 -0.617 . . . . 0.0 110.978 177.549 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 89.1 mt -61.46 -43.12 96.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 178.696 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -62.18 -45.87 91.48 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 179.825 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -66.5 -34.23 77.45 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.747 0.308 . . . . 0.0 111.207 -178.368 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.35 -18.95 65.13 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 179.677 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.8 mt -108.2 12.15 26.86 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.573 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 8.5 mttm -56.82 131.6 49.87 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 176.869 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 14.5 m -72.7 -20.39 19.3 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.634 -179.329 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.7 -30.74 41.13 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 113.779 -1.555 . . . . 0.0 110.921 -178.951 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 25.0 t -166.27 85.8 0.92 Allowed Pre-proline 0 C--O 1.239 0.512 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.418 -177.977 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.81 149.56 48.21 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 117.314 -1.324 . . . . 0.0 112.415 178.477 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -137.29 93.39 2.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.589 0.709 . . . . 0.0 110.183 -177.246 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -58.4 -47.34 88.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 -177.438 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 26.5 pttt -58.77 -31.4 68.34 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-O 121.696 0.76 . . . . 0.0 110.347 -176.38 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.0 ttm-85 -68.81 -43.33 75.81 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.227 -178.673 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -63.24 -48.81 76.68 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.556 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.9 mt -57.48 -42.79 83.34 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -176.762 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -65.53 -38.58 90.07 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.54 0.686 . . . . 0.0 111.495 179.163 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.69 -47.07 70.48 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.034 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.88 -45.58 82.46 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.206 178.859 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -64.75 -34.63 78.78 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -176.486 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -44.11 66.42 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 176.282 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.79 -35.6 66.47 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.28 0.562 . . . . 0.0 110.898 179.429 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.46 -18.65 69.97 Favored Glycine 0 C--O 1.239 0.448 0 N-CA-C 114.762 0.665 . . . . 0.0 114.762 -179.858 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 12.7 t -109.31 -12.4 14.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.917 0.858 . . . . 0.0 110.581 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -68.78 146.25 53.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.163 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -80.35 80.58 6.76 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-O 122.508 1.147 . . . . 0.0 109.031 178.144 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 29.3 m -94.3 48.17 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 123.071 1.415 . . . . 0.0 107.576 179.754 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.68 173.62 3.35 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.709 -177.978 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 34.3 m -48.46 -35.33 12.73 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.517 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -55.52 -44.34 76.58 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.267 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -87.62 -38.71 12.25 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.397 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -179.41 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.21 -37.74 81.2 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -176.749 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -66.27 -33.73 76.4 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.567 0.222 . . . . 0.0 111.426 -179.553 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -89.35 -3.29 58.52 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 121.076 -0.25 . . . . 0.0 111.316 179.172 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -128.12 43.42 3.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.875 0.845 . . . . 0.0 112.398 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -64.17 -28.56 69.84 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 121.722 -0.611 . . . . 0.0 112.466 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -70.53 -24.26 62.78 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.501 0.667 . . . . 0.0 112.034 179.176 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 86.7 t -70.87 -43.82 76.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 106.152 -1.796 . . . . 0.0 106.152 177.302 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 49.5 t -62.53 -35.62 70.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 178.244 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.99 -35.93 81.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 119.042 -0.504 . . . . 0.0 111.645 177.318 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.5 m -77.06 -39.17 50.87 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.165 0.893 . . . . 0.0 108.734 179.32 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 34.9 mt -57.5 -35.01 69.69 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.813 0.34 . . . . 0.0 111.664 179.019 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -63.3 -29.12 70.5 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.878 -0.513 . . . . 0.0 111.392 175.623 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -76.49 -46.24 27.6 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.657 0.265 . . . . 0.0 111.708 -179.422 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 1.1 pt -74.77 -23.57 17.78 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.932 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -176.929 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.449 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 1.7 mtm180 -59.94 -20.65 58.67 Favored 'General case' 0 C--O 1.214 -0.788 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 176.152 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -119.51 19.41 12.66 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.976 0.51 . . . . 0.0 111.48 178.854 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -62.03 117.91 6.59 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 121.063 0.458 . . . . 0.0 111.355 -177.564 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -79.49 -26.59 41.59 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -176.475 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.14 -40.93 86.84 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.692 -0.403 . . . . 0.0 112.081 -175.354 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -131.55 117.0 18.16 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -178.464 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -59.05 -43.62 91.7 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.617 179.039 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -57.79 -42.24 83.76 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.062 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -57.53 -43.12 82.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 O-C-N 121.809 -0.557 . . . . 0.0 109.542 177.454 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -43.03 94.36 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 178.559 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -63.87 -49.28 73.39 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.121 0.263 . . . . 0.0 110.476 -178.336 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -70.88 -40.63 72.13 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.958 -178.222 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.14 -38.77 80.47 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.14 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.449 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.79 -50.17 70.05 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 177.757 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.68 -42.15 83.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 77.0 t -70.44 -52.06 32.59 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.859 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.135 -178.618 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -54.48 -44.47 72.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.641 0.258 . . . . 0.0 110.412 -177.171 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 24.8 m -65.25 -38.43 90.33 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 122.909 0.483 . . . . 0.0 111.022 179.358 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 44.1 mtt180 -59.99 -30.71 69.31 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 121.838 -0.539 . . . . 0.0 110.752 176.573 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 3.8 mt -76.24 -30.88 58.08 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 -176.782 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.11 -37.95 89.23 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.899 177.575 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.7 m -76.81 -15.03 59.84 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 177.982 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -96.92 -11.09 25.13 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 122.154 -0.341 . . . . 0.0 110.811 178.358 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -105.58 -176.2 24.05 Favored Glycine 0 N--CA 1.451 -0.323 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 -177.04 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.257 1.473 0 CA-C-O 116.158 -1.877 . . . . 0.0 108.325 -177.038 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -71.84 154.08 41.5 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 177.113 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 25.1 m -73.31 144.99 84.96 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 178.278 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.07 165.66 30.59 Favored 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 118.419 -0.587 . . . . 0.0 112.491 177.717 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 15.0 m -60.92 159.73 10.88 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -178.029 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 22.4 t -53.0 -47.04 54.47 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.122 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 178.841 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -63.74 -34.19 77.33 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.585 -177.252 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -68.76 -40.5 79.71 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 122.464 1.126 . . . . 0.0 108.526 179.42 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -73.34 -34.86 65.88 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.1 -177.731 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 4.5 tt -58.42 -36.14 73.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.054 179.408 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -54.18 -43.13 70.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 118.456 0.571 . . . . 0.0 109.862 178.325 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -67.82 -56.32 9.6 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.556 178.372 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -44.99 81.16 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.333 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 14.4 t-160 -58.52 -43.56 89.21 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 179.166 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.5 m -64.74 -37.85 88.99 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 179.495 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.8 mm-40 -63.38 -38.14 90.01 Favored 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.05 178.307 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.11 -44.25 87.03 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.535 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.4 mmtt -62.52 -46.3 89.04 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -179.514 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -64.6 -33.59 76.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.871 0.367 . . . . 0.0 111.159 -178.243 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.84 -18.21 65.18 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 179.371 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 26.1 mt -108.07 12.15 27.08 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.112 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -56.12 127.81 32.43 Favored 'General case' 0 CA--C 1.493 -1.219 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 176.527 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 29.6 m -70.25 -20.48 22.87 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.211 178.536 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -80.97 -27.41 36.0 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.155 -1.384 . . . . 0.0 111.091 177.864 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 4.2 m -160.81 75.62 2.63 Favored Pre-proline 0 N--CA 1.473 0.676 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -74.35 143.35 31.31 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 113.523 -3.851 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -137.25 98.19 3.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.788 0.804 . . . . 0.0 109.734 -178.65 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.44 -45.51 93.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.509 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -59.55 -31.05 69.06 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 -178.362 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -70.37 -41.29 73.3 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.762 -0.775 . . . . 0.0 108.96 -178.1 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.03 -48.35 76.66 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 175.889 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 96.7 mt -57.27 -43.18 82.87 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -176.719 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -64.58 -39.03 93.0 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.532 0.682 . . . . 0.0 111.3 178.677 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -65.74 -48.5 71.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.648 0.737 . . . . 0.0 109.695 178.599 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -57.86 -48.27 80.3 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.997 178.641 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -62.94 -33.07 74.57 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 119.847 -0.741 . . . . 0.0 112.803 -175.631 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.35 -48.65 40.18 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.44 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -30.67 42.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.801 0.81 . . . . 0.0 110.155 -178.849 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -63.85 -23.6 67.57 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 115.846 1.098 . . . . 0.0 115.846 176.821 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 9.0 t -104.88 -26.48 12.2 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 117.883 0.841 . . . . 0.0 110.367 178.766 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.2 mp -57.0 140.5 48.82 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 176.058 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -76.99 84.41 3.51 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 122.339 1.066 . . . . 0.0 110.692 -178.914 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 16.6 m -103.42 68.95 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 CA-C-O 126.794 3.188 . . . . 0.0 105.489 178.039 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.0 t -80.41 173.73 12.31 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 109.892 -3.322 . . . . 0.0 105.204 172.636 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.2 m -49.36 -36.73 22.4 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -175.365 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -54.29 -43.77 71.35 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -179.017 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.0 mp -88.56 -38.98 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.801 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 -178.03 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 4.8 mt -61.61 -39.4 91.12 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -175.886 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -68.82 -31.0 69.67 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.193 -0.203 . . . . 0.0 110.644 -177.861 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -87.27 -7.04 58.28 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 121.122 -0.231 . . . . 0.0 111.073 176.781 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -129.6 45.77 2.75 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.545 0.688 . . . . 0.0 112.11 179.194 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -63.89 -25.95 68.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.877 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.07 -29.03 69.3 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.846 0.831 . . . . 0.0 112.337 178.556 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 65.0 t -71.08 -45.01 74.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 178.553 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 57.2 t -61.0 -38.1 78.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.149 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.25 -38.95 92.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.88 177.612 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 95.3 m -71.94 -38.69 69.79 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 118.371 0.532 . . . . 0.0 109.961 -178.613 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 63.3 mt -58.63 -34.89 71.69 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.116 0.484 . . . . 0.0 111.461 179.422 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -67.26 -29.13 68.67 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 121.613 -0.679 . . . . 0.0 111.012 176.27 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -71.52 -42.1 68.37 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.725 0.298 . . . . 0.0 111.151 179.861 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 6.0 pt -78.65 -23.28 13.12 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.266 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.54 ' HD2' ' HA ' ' A' ' 540' ' ' ALA . 7.4 mtp180 -64.69 -13.31 53.84 Favored 'General case' 0 C--O 1.217 -0.638 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 175.655 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.89 18.47 13.25 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.947 0.499 . . . . 0.0 111.544 175.07 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -66.47 118.07 9.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 112.044 -177.677 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -81.81 -26.64 34.18 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -177.573 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.54 -29.87 68.54 Favored 'General case' 0 C--O 1.219 -0.512 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -175.151 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -144.69 118.88 9.48 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.415 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -61.76 -46.58 88.95 Favored 'General case' 0 C--O 1.213 -0.86 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.452 -178.626 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -56.04 -38.96 71.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.17 0.509 . . . . 0.0 112.109 -175.175 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.8 t -55.96 -45.31 80.07 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 O-C-N 122.076 -0.39 . . . . 0.0 110.111 177.539 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -68.06 -40.78 82.69 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.754 178.432 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.09 -47.98 80.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 119.303 0.956 . . . . 0.0 111.567 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.7 tptt -72.18 -37.91 69.21 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 119.076 -1.049 . . . . 0.0 111.378 -178.741 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.08 -38.06 78.56 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.254 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.54 ' HA ' ' HD2' ' A' ' 527' ' ' ARG . . . -66.63 -49.97 64.52 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.358 179.275 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -42.48 83.59 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.886 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 75.3 t -70.59 -53.45 22.37 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.262 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.965 -177.887 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 69.9 t80 -53.81 -46.97 71.26 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.184 0.516 . . . . 0.0 110.312 -176.011 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 27.8 m -60.07 -38.15 82.01 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.38 0.672 . . . . 0.0 112.343 178.286 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -65.21 -27.41 68.66 Favored 'General case' 0 C--N 1.32 -0.709 0 O-C-N 121.419 -0.801 . . . . 0.0 111.785 176.749 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 9.7 mt -75.59 -35.77 60.49 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -174.651 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -33.95 73.55 Favored 'General case' 0 C--O 1.205 -1.273 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.67 176.704 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 45.3 t -68.89 -43.46 75.22 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.315 175.019 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 80.8 mtt85 -72.09 -28.42 63.29 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 -178.469 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -118.99 8.63 12.5 Favored Glycine 0 C--N 1.323 -0.168 0 CA-C-O 118.815 -0.992 . . . . 0.0 115.411 -175.676 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 24.1 m . . . . . 0 C--O 1.244 0.772 0 O-C-N 124.555 0.797 . . . . 0.0 110.378 -175.513 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -66.53 147.6 53.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 177.756 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 40.6 m -126.38 71.59 71.63 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 123.187 0.305 . . . . 0.0 110.296 178.859 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.95 153.84 67.62 Favored 'Trans proline' 0 C--O 1.238 0.483 0 N-CA-C 114.213 0.813 . . . . 0.0 114.213 -178.185 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.1 m -67.7 162.76 23.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.073 -179.793 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.6 t -54.21 -44.19 63.64 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.38 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -66.92 -33.18 75.02 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 120.762 0.315 . . . . 0.0 111.721 -178.274 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.18 -39.98 82.38 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.675 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -73.72 -32.18 63.76 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.935 -177.242 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -54.58 -38.96 67.33 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.253 178.833 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -53.18 -38.71 63.06 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 121.321 -0.151 . . . . 0.0 111.264 -178.693 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -67.83 -57.67 5.89 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.568 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.88 -46.22 90.0 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -174.526 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -58.92 -43.16 91.08 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -179.501 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 67.0 m -63.28 -40.4 97.28 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 117.869 0.304 . . . . 0.0 111.213 -178.935 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -63.57 -37.52 87.65 Favored 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 120.671 -0.411 . . . . 0.0 111.149 178.862 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 94.3 mt -59.9 -44.06 93.52 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.989 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.168 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 49.2 mmtt -62.67 -44.67 95.66 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 122.153 -0.342 . . . . 0.0 111.919 -179.746 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -65.13 -33.88 77.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.781 0.324 . . . . 0.0 111.073 -178.189 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.89 -16.55 64.39 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 179.249 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 38.4 mt -111.08 12.24 21.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.868 -177.459 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -55.44 129.4 38.56 Favored 'General case' 0 C--O 1.21 -1.011 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 176.665 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.9 t -62.62 -39.75 85.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 122.16 0.981 . . . . 0.0 108.446 178.507 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.12 -28.07 64.04 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.066 -1.425 . . . . 0.0 113.414 -178.021 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.1 t -159.48 76.38 3.06 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -177.593 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -75.33 146.6 31.68 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 117.495 -1.203 . . . . 0.0 113.812 179.516 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -137.37 101.64 4.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.31 0.576 . . . . 0.0 111.397 178.575 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -56.58 -46.17 82.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -179.429 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 15.0 pttt -58.77 -32.2 69.06 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 121.857 0.837 . . . . 0.0 109.791 -176.478 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -70.83 -40.48 72.41 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.391 -1.277 . . . . 0.0 108.888 -176.476 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.51 -49.7 68.02 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 175.624 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.6 mt -56.91 -43.1 81.04 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.256 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -66.01 -37.08 84.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.467 0.651 . . . . 0.0 111.625 179.997 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.84 -47.71 68.21 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.772 0.796 . . . . 0.0 109.316 177.702 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.71 -44.97 82.07 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.77 178.632 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -60.57 -36.8 79.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 119.036 0.835 . . . . 0.0 112.673 -177.165 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -73.77 -42.64 60.74 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 178.69 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -58.91 -34.29 71.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.164 0.507 . . . . 0.0 110.637 -179.436 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.1 -17.67 66.0 Favored Glycine 0 C--O 1.241 0.565 0 N-CA-C 114.848 0.699 . . . . 0.0 114.848 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.8 t -110.69 -14.7 13.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 117.699 0.75 . . . . 0.0 110.587 -179.131 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.2 mt -67.44 145.86 54.58 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.489 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -79.16 84.3 5.14 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 122.53 1.157 . . . . 0.0 109.797 178.37 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.8 m -96.8 48.5 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 CA-C-O 123.351 1.548 . . . . 0.0 108.126 -178.966 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.5 t -67.26 174.43 3.25 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 -179.436 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 13.1 m -49.23 -34.75 15.65 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -173.361 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -53.7 -44.06 69.47 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.73 0.271 . . . . 0.0 111.73 178.187 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.5 mp -88.48 -40.69 13.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.53 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.82 -38.04 80.89 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -175.644 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -66.99 -32.61 73.96 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.559 -179.002 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -90.23 -4.3 57.29 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.347 -0.221 . . . . 0.0 111.088 178.813 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -128.58 45.91 2.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.777 0.799 . . . . 0.0 112.484 -179.355 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 29.0 p -66.06 -26.91 67.71 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.426 -0.796 . . . . 0.0 112.399 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.4 -28.26 66.93 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.596 1.189 . . . . 0.0 112.465 178.383 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 91.4 t -68.69 -44.78 82.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 178.968 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.79 -37.5 79.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 178.354 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.42 -34.32 76.54 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.046 177.806 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.8 m -78.53 -39.47 37.85 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 118.48 0.582 . . . . 0.0 109.676 -179.801 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 44.0 mt -57.7 -34.92 69.96 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.962 0.41 . . . . 0.0 111.407 178.591 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -63.73 -29.13 70.39 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.879 -0.513 . . . . 0.0 111.629 175.232 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -74.02 -42.59 60.1 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 122.098 -0.376 . . . . 0.0 111.977 -179.741 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER -78.83 -21.64 12.88 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -178.406 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . 0.422 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -65.02 -11.21 36.52 Favored 'General case' 0 C--O 1.214 -0.78 0 O-C-N 121.97 -0.456 . . . . 0.0 112.097 175.554 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 41.0 ptt85 -122.13 19.44 10.74 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 122.998 0.519 . . . . 0.0 111.596 175.334 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -65.48 120.46 12.9 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -175.606 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -85.98 -27.92 24.56 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -177.434 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.86 -41.45 95.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.245 0.545 . . . . 0.0 111.616 -175.289 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -132.35 112.5 12.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.948 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . 0.454 ' HZ1' ' CD ' ' A' ' 537' ' ' GLU . 9.4 tmtt? -62.62 -33.57 75.28 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.272 -179.314 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -58.17 -41.98 85.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.521 0.676 . . . . 0.0 111.34 -179.969 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 94.3 t -60.27 -41.02 85.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 O-C-N 121.876 -0.515 . . . . 0.0 109.618 178.238 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 38.1 ttm -57.8 -47.38 82.73 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 120.814 0.34 . . . . 0.0 110.122 179.073 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . 0.454 ' CD ' ' HZ1' ' A' ' 533' ' ' LYS . 5.6 mm-40 -65.24 -48.38 73.51 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.035 -179.458 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -72.03 -37.81 69.68 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 118.627 -1.229 . . . . 0.0 111.147 -175.399 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.94 -38.66 83.06 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.01 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . 0.422 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -66.83 -48.97 67.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.861 -1.063 . . . . 0.0 113.709 179.425 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -41.83 88.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -179.705 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 63.3 t -70.6 -51.03 40.52 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.593 -178.689 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -55.08 -44.74 75.11 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.597 0.237 . . . . 0.0 110.486 -177.554 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 20.7 m -67.07 -35.55 80.08 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 123.019 0.528 . . . . 0.0 110.727 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 16.0 mtt85 -60.58 -29.3 69.1 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 121.807 -0.558 . . . . 0.0 110.157 175.606 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 9.4 mt -76.2 -34.44 59.28 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 -175.603 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . 0.483 ' HA ' ' HZ2' ' A' ' 547' ' ' LYS . 0.0 OUTLIER -60.77 -31.5 70.85 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.061 178.205 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.6 m -79.6 -13.61 59.4 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 176.908 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -101.97 -31.11 10.83 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -179.398 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . 173.87 152.38 8.91 Favored Glycine 0 CA--C 1.519 0.316 0 N-CA-C 114.667 0.627 . . . . 0.0 114.667 179.476 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 2.2 m . . . . . 0 C--O 1.246 0.917 0 N-CA-C 115.999 1.851 . . . . 0.0 115.999 178.832 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -70.46 158.51 35.92 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 176.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 60.6 m -146.3 143.48 19.19 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.727 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.29 149.64 57.59 Favored 'Trans proline' 0 C--O 1.239 0.551 0 N-CA-C 113.966 0.718 . . . . 0.0 113.966 -179.099 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.5 m -71.35 165.61 23.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.274 179.191 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 49.9 t -54.38 -45.19 69.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.064 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 179.652 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -64.74 -34.13 77.59 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.796 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -68.0 -41.29 82.47 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 178.604 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -72.35 -32.61 66.63 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.219 -177.84 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -56.61 -38.85 72.63 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.186 178.846 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -53.42 -40.45 65.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 118.345 0.52 . . . . 0.0 110.654 -179.065 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 56.8 tttt -67.36 -56.68 8.7 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 176.856 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -45.91 89.89 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -176.119 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -60.37 -43.32 96.67 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -179.739 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 67.4 m -62.17 -40.47 96.13 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.644 -178.574 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -63.01 -38.72 92.33 Favored 'General case' 0 CA--C 1.508 -0.662 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.402 178.61 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -60.23 -43.57 93.64 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 179.472 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.41 -41.95 93.06 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.524 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -65.73 -34.33 77.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.801 0.334 . . . . 0.0 110.875 179.623 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.35 -17.13 64.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 179.398 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 25.8 mt -108.59 12.14 26.17 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -178.614 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 6.0 mtpt -54.88 130.97 43.25 Favored 'General case' 0 C--O 1.209 -1.068 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 177.729 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.0 t -63.75 -41.17 91.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 122.468 1.127 . . . . 0.0 108.129 177.507 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -28.95 68.23 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 113.465 -1.698 . . . . 0.0 113.632 -179.337 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.3 t -159.75 76.08 2.99 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.799 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -75.56 144.5 28.53 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 116.6 -1.8 . . . . 0.0 113.535 179.407 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -137.08 104.27 5.38 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.277 0.561 . . . . 0.0 111.099 179.477 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.04 -46.09 94.69 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.934 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -57.02 -32.67 66.39 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 120.96 0.41 . . . . 0.0 109.931 -177.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -70.12 -40.29 74.94 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -176.234 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.95 -49.04 71.91 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 176.007 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 74.9 mt -57.31 -44.1 83.85 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -175.998 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.62 -40.15 96.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.76 0.791 . . . . 0.0 110.336 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -68.91 -46.92 67.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.361 0.6 . . . . 0.0 110.49 179.39 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.88 -48.64 75.22 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.477 179.139 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -63.02 -35.62 80.83 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -175.483 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -69.98 -43.27 71.81 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 176.707 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -59.29 -34.74 72.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.343 0.592 . . . . 0.0 110.336 -179.338 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.17 -17.98 62.09 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-O 119.207 -0.774 . . . . 0.0 114.745 179.78 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.3 t -112.95 -7.7 13.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.149 0.975 . . . . 0.0 111.064 -179.449 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.5 mt -72.72 148.57 44.55 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.523 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -78.57 84.58 4.68 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 122.807 1.289 . . . . 0.0 109.985 178.388 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 508' ' ' VAL . . . . . . . . . . . . . 26.8 m -97.07 46.83 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.325 0 CA-C-O 122.748 1.261 . . . . 0.0 108.939 -178.181 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.0 t -67.28 172.43 4.81 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -178.244 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 15.7 m -49.36 -32.15 10.78 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -173.949 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.36 -45.3 76.52 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 122.348 -0.22 . . . . 0.0 111.528 177.799 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.5 mp -86.86 -42.39 15.43 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.818 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.08 -40.13 80.3 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -175.715 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -69.55 -29.43 67.01 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.354 -177.654 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -90.53 -3.34 57.67 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 122.338 -0.227 . . . . 0.0 110.979 177.537 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -128.76 45.3 2.81 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.71 0.767 . . . . 0.0 112.388 179.382 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 22.3 p -64.66 -27.35 68.86 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.881 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.39 -24.59 65.7 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 122.1 0.952 . . . . 0.0 112.207 178.167 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.5 t -71.74 -45.98 63.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 178.363 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.82 -35.54 71.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.846 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -58.21 -46.1 86.46 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 176.46 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.7 m -71.2 -39.15 71.97 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.641 -175.331 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 523' ' ' LEU . . . . . . . . . . . . . 72.7 mt -57.61 -35.47 70.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.884 0.373 . . . . 0.0 111.186 179.044 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -66.06 -29.12 69.41 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 121.789 -0.569 . . . . 0.0 112.382 176.912 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.92 -53.11 10.84 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.826 0.822 . . . . 0.0 110.419 179.633 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 526' ' ' ILE . . . . . . . . . . . . . 22.6 pt -65.47 -24.64 35.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -179.419 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.28 -16.92 61.79 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 176.004 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.73 19.2 13.24 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.791 0.437 . . . . 0.0 111.111 177.072 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -65.72 120.86 13.75 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 123.201 0.6 . . . . 0.0 111.462 -179.027 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -91.5 -19.42 22.82 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -178.126 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -69.49 -22.81 63.58 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.129 -177.754 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.68 128.98 12.0 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.749 174.774 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -64.28 -49.5 71.59 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.222 -178.454 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -58.17 -38.36 76.49 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.251 0.548 . . . . 0.0 111.808 -173.839 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.95 -44.9 79.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 176.873 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.6 ttp -68.32 -43.26 77.97 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 119.256 -0.402 . . . . 0.0 110.362 179.431 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -64.36 -47.78 78.03 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.406 -0.518 . . . . 0.0 112.354 -179.411 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -69.82 -38.09 76.46 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.42 -178.3 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.2 -40.73 86.7 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-O 121.619 0.723 . . . . 0.0 109.287 178.133 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.61 73.87 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.524 -1.217 . . . . 0.0 112.638 -179.923 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -42.48 90.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.454 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.2 t -70.5 -51.11 40.34 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.994 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.414 -178.317 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -54.49 -45.09 73.15 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -177.781 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.9 m -66.19 -35.11 79.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.297 0.57 . . . . 0.0 111.262 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 23.1 mtt85 -61.65 -30.07 70.48 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.783 -0.573 . . . . 0.0 109.947 174.933 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 546' ' ' LEU . . . . . . . . . . . . . 8.5 mt -76.68 -34.05 58.22 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -175.754 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -28.14 68.85 Favored 'General case' 0 C--O 1.217 -0.639 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.67 178.212 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.9 m -78.27 -8.52 58.47 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.92 -1.037 . . . . 0.0 111.991 177.769 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 64.1 mtt85 -116.87 -19.19 9.96 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -179.696 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -170.82 157.93 29.24 Favored Glycine 0 CA--C 1.518 0.281 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.971 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 12.9 m . . . . . 0 C--O 1.242 0.662 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.686 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--O 1.226 -0.177 0 CA-C-O 121.091 0.472 . . . . 0.0 111.615 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.414 HG13 ' HB3' ' A' ' 506' ' ' LEU . 53.7 t -56.18 -47.78 80.24 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.907 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.751 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -63.44 -34.18 77.18 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -67.16 -42.74 83.83 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 177.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 17.5 mttt -69.43 -35.48 75.72 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 121.727 0.775 . . . . 0.0 109.997 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.437 HD21 HG21 ' A' ' 519' ' ' VAL . 1.5 tm? -57.13 -37.42 71.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.879 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -54.46 -40.68 68.63 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.405 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -72.36 -54.06 10.52 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.131 177.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.47 -46.75 73.43 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 -177.258 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.4 t-160 -61.33 -41.06 96.39 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 52.5 m -64.06 -40.57 96.56 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.97 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 72.3 mm-40 -63.72 -43.09 97.59 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-N 118.153 0.433 . . . . 0.0 110.652 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.02 -46.89 66.02 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.19 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 177.568 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -67.01 -39.5 87.11 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -177.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -68.57 -28.07 66.63 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 122.157 -0.339 . . . . 0.0 110.755 177.855 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.69 -18.42 62.82 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.6 mt -105.99 12.08 30.89 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.874 -177.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 52.4 mttt -54.09 127.29 26.03 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.6 t -62.26 -42.11 94.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.932 0.872 . . . . 0.0 109.678 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.33 -30.66 69.68 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.205 -1.362 . . . . 0.0 112.943 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 14.2 t -155.31 75.9 5.17 Favored Pre-proline 0 C--O 1.244 0.769 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -175.053 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -74.95 146.65 33.13 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 117.394 -1.271 . . . . 0.0 112.72 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -137.28 100.76 4.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.331 0.586 . . . . 0.0 109.762 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.72 -46.13 96.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -58.09 -31.12 66.81 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.064 0.227 . . . . 0.0 110.447 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -69.28 -41.11 77.28 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.441 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.69 -49.04 69.99 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.498 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 83.4 mt -56.85 -44.18 81.91 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.07 -41.07 97.77 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.6 0.714 . . . . 0.0 110.824 179.3 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.445 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.93 -47.3 69.07 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.286 0.565 . . . . 0.0 109.767 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.441 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.29 -46.32 79.82 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.186 177.641 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -64.66 -35.36 80.79 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 119.032 0.833 . . . . 0.0 113.123 -176.171 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -68.88 -46.61 67.95 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 176.462 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.427 HD21 HD23 ' A' ' 475' ' ' LEU . 0.9 OUTLIER -57.69 -33.23 68.15 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.427 0.632 . . . . 0.0 110.547 -179.417 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.76 -19.21 67.09 Favored Glycine 0 C--O 1.238 0.345 0 CA-C-O 119.312 -0.716 . . . . 0.0 114.543 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.7 t -109.98 -13.75 14.36 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.91 0.855 . . . . 0.0 110.237 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.414 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.0 mt -67.3 145.91 54.65 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.964 -0.46 . . . . 0.0 110.344 179.382 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.426 ' O ' HD13 ' A' ' 512' ' ' ILE . 28.7 tt0 -79.37 84.45 5.28 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-O 122.79 1.281 . . . . 0.0 109.809 178.501 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.916 HG21 HD22 ' A' ' 546' ' ' LEU . 27.8 m -95.69 46.49 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 CA-C-O 122.9 1.333 . . . . 0.0 108.433 -179.055 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.4 t -66.67 171.78 4.84 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 -177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.1 m -49.26 -30.9 7.89 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -174.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -56.09 -46.58 78.99 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 175.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.426 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -86.72 -41.77 15.08 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.455 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.438 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -57.51 -39.69 77.05 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.84 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -68.12 -31.21 70.64 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.392 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -90.38 -4.44 57.06 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 122.172 -0.33 . . . . 0.0 111.331 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -127.94 41.11 3.56 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.276 0.56 . . . . 0.0 111.458 -179.291 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.2 p -63.64 -27.93 69.56 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 121.604 -0.685 . . . . 0.0 112.776 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.13 -26.41 68.18 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.617 0.722 . . . . 0.0 111.842 177.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.437 HG21 HD21 ' A' ' 475' ' ' LEU . 47.6 t -71.93 -43.15 68.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 44.9 t -62.71 -35.23 69.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 178.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.09 85.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 119.228 -0.415 . . . . 0.0 111.368 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.0 m -78.14 -37.91 44.96 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 118.991 0.814 . . . . 0.0 109.719 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.568 HD23 HD11 ' A' ' 526' ' ' ILE . 39.5 mt -57.97 -35.0 70.56 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.076 0.465 . . . . 0.0 111.178 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -64.56 -29.08 70.11 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.803 -0.561 . . . . 0.0 111.536 175.102 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -74.31 -41.62 60.83 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.568 HD11 HD23 ' A' ' 523' ' ' LEU . 1.2 pt -78.74 -23.14 13.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.103 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.214 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -13.07 32.64 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 176.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.7 ptt180 -119.14 16.35 13.23 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 122.822 0.449 . . . . 0.0 110.841 176.72 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -64.66 121.82 15.38 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.059 0.457 . . . . 0.0 112.103 -175.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -92.29 -25.62 18.5 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -177.375 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.02 -25.51 65.43 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.637 -177.001 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.86 121.22 9.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.915 0.388 . . . . 0.0 110.371 174.627 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -39.99 94.98 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.91 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -60.68 -40.95 94.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.614 0.721 . . . . 0.0 111.745 -176.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 59.4 t -56.01 -43.39 75.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.957 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.7 ttp -66.27 -40.73 90.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 122.066 0.146 . . . . 0.0 110.621 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.42 -48.41 70.12 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -69.7 -38.26 76.9 Favored 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 118.977 -1.089 . . . . 0.0 110.244 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.63 -39.87 81.75 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.2 -48.37 68.09 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -40.79 90.53 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 62.1 t -70.63 -53.1 23.73 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.3 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 543' ' ' TYR . . . . . 0.529 ' CE1' ' HD3' ' A' ' 547' ' ' LYS . 51.6 t80 -55.0 -41.74 71.65 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.181 0.515 . . . . 0.0 110.901 -177.213 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 544' ' ' THR . . . . . 0.466 ' HA ' ' HE3' ' A' ' 547' ' ' LYS . 30.0 m -65.27 -38.55 90.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.141 0.496 . . . . 0.0 111.197 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 -64.74 -27.05 68.64 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.177 177.015 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.916 HD22 HG21 ' A' ' 508' ' ' VAL . 11.9 mt -73.94 -37.8 64.45 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -176.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 547' ' ' LYS . . . . . 0.529 ' HD3' ' CE1' ' A' ' 543' ' ' TYR . 5.2 mtmp? -63.76 -24.73 67.88 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.273 178.114 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 C--N 1.319 -0.722 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.127 178.484 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.221 -0.406 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.422 HG13 ' HB3' ' A' ' 506' ' ' LEU . 48.6 t -53.75 -49.25 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.429 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.8 pt-20 -65.92 -32.28 73.69 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.693 -178.831 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -67.47 -40.71 85.31 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 12.7 mtpt -72.32 -32.99 67.03 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.499 -176.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.7 -40.11 71.93 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.548 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -53.23 -39.85 64.11 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 121.245 -0.182 . . . . 0.0 110.895 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -71.97 -55.24 7.79 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.265 176.291 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -47.06 78.43 Favored 'General case' 0 C--O 1.218 -0.563 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -175.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -61.47 -39.88 92.49 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 59.1 m -64.92 -41.25 95.72 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.587 179.253 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.456 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.9 mm-40 -63.19 -43.17 98.94 Favored 'General case' 0 CA--C 1.506 -0.718 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.805 178.762 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.14 -47.62 66.76 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -67.36 -37.68 83.58 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -176.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -67.73 -31.64 71.71 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.55 -19.09 65.24 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 23.8 mt -103.06 12.19 36.27 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 38.6 mttt -55.57 128.52 34.93 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 72.2 t -61.43 -43.12 96.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.816 0.817 . . . . 0.0 109.66 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -74.23 -19.84 60.38 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.469 -1.242 . . . . 0.0 113.456 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 7.3 m -156.39 69.0 4.79 Favored Pre-proline 0 N--CA 1.47 0.574 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -176.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.58 145.11 29.16 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 114.267 -3.355 . . . . 0.0 112.573 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -137.33 96.76 3.33 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.892 0.853 . . . . 0.0 109.867 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.409 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.6 OUTLIER -56.32 -46.43 81.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -178.931 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.35 -30.67 69.69 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -69.73 -40.43 76.22 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 -178.037 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.456 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.97 -49.1 71.61 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.814 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 87.5 mt -56.64 -43.06 79.89 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -64.39 -38.54 91.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.387 0.613 . . . . 0.0 111.425 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.456 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.03 -48.53 68.07 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 177.803 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.456 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -56.38 -43.73 79.5 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.207 178.55 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -65.59 -33.78 76.7 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 119.315 0.961 . . . . 0.0 112.912 -177.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.98 -46.58 64.89 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 175.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -34.36 65.98 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.44 0.638 . . . . 0.0 110.983 -179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.92 -18.43 68.65 Favored Glycine 0 C--O 1.237 0.333 0 CA-C-O 119.235 -0.759 . . . . 0.0 114.883 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 15.1 t -110.29 -14.64 14.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 117.992 0.896 . . . . 0.0 110.354 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.422 ' HB3' HG13 ' A' ' 471' ' ' VAL . 3.5 mt -65.39 144.01 57.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.0 0.428 . . . . 0.0 110.728 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.464 ' O ' HD13 ' A' ' 512' ' ' ILE . 34.4 tt0 -78.62 84.34 4.73 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 122.46 1.124 . . . . 0.0 109.192 177.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.861 HG21 HD22 ' A' ' 546' ' ' LEU . 29.5 m -97.13 46.77 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-O 123.11 1.433 . . . . 0.0 108.922 -178.423 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.6 t -67.34 172.93 4.34 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.3 m -49.11 -33.68 12.34 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -173.07 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -55.18 -43.06 73.98 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 178.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.464 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.1 mp -88.45 -41.76 14.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.445 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.54 -39.16 83.04 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.404 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -67.13 -32.46 73.6 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.682 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -88.99 -3.85 58.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.999 -0.28 . . . . 0.0 110.56 178.545 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -129.01 42.73 3.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.4 p -64.28 -28.16 69.53 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.499 -0.751 . . . . 0.0 112.248 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -67.51 -24.05 65.53 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.506 0.67 . . . . 0.0 111.952 177.98 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 60.8 t -71.97 -45.13 65.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 178.668 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 42.7 t -62.24 -35.51 69.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.77 94.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.175 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 98.6 m -74.41 -38.99 62.94 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 119.168 0.895 . . . . 0.0 110.407 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.676 HD23 HD11 ' A' ' 526' ' ' ILE . 63.5 mt -57.29 -35.15 69.44 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.998 0.428 . . . . 0.0 111.334 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -65.7 -29.23 69.74 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.769 -0.582 . . . . 0.0 111.762 175.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -73.02 -44.42 60.9 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.974 0.416 . . . . 0.0 110.877 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.676 HD11 HD23 ' A' ' 523' ' ' LEU . 17.3 pt -78.54 -21.94 13.16 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.784 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -176.023 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.45 -18.36 58.58 Favored 'General case' 0 C--O 1.214 -0.803 0 O-C-N 121.741 -0.6 . . . . 0.0 111.968 175.402 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.75 19.42 13.16 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 122.897 0.479 . . . . 0.0 111.379 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -64.64 113.67 3.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.97 0.414 . . . . 0.0 112.01 -177.191 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -75.22 -30.0 60.44 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -176.761 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.25 95.77 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -174.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -131.21 110.83 11.42 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.11 -0.329 . . . . 0.0 110.11 -178.171 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 39.3 tptt -56.27 -43.85 79.19 Favored 'General case' 0 C--O 1.207 -1.139 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.211 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -55.49 -42.67 74.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.123 0.487 . . . . 0.0 112.172 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.1 t -57.09 -44.46 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -63.87 -44.24 93.68 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.59 -47.47 78.54 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.11 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 41.5 tptt -70.27 -38.95 75.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 118.488 -1.285 . . . . 0.0 110.715 -178.124 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.06 -40.94 86.72 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.368 0.604 . . . . 0.0 109.392 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -62.9 -48.73 77.7 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.081 -0.963 . . . . 0.0 113.503 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -41.76 89.68 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.2 t -70.51 -52.81 26.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.876 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.514 -177.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 543' ' ' TYR . . . . . 0.531 ' CE1' ' HD3' ' A' ' 547' ' ' LYS . 37.5 t80 -54.91 -42.51 72.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.343 0.592 . . . . 0.0 111.253 -177.386 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.5 m -66.95 -36.9 83.26 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.877 0.37 . . . . 0.0 110.447 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 10.7 mtt85 -63.69 -30.06 71.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.761 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.861 HD22 HG21 ' A' ' 508' ' ' VAL . 13.2 mt -71.7 -38.23 70.59 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -175.514 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 547' ' ' LYS . . . . . 0.531 ' HD3' ' CE1' ' A' ' 543' ' ' TYR . 4.2 mtmp? -61.08 -29.5 69.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.935 -1.029 . . . . 0.0 112.317 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 C--N 1.32 -0.685 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.582 176.807 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--O 1.224 -0.252 0 CA-C-O 120.709 0.29 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.408 HG13 ' HB3' ' A' ' 506' ' ' LEU . 34.1 t -55.17 -46.85 77.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.019 0 O-C-N 122.114 -0.366 . . . . 0.0 110.719 178.364 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.26 -34.15 74.69 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -67.03 -40.93 87.31 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 122.378 1.085 . . . . 0.0 108.678 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -74.08 -34.8 64.13 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.35 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.567 HD21 HG21 ' A' ' 519' ' ' VAL . 4.2 tt -58.88 -36.82 75.28 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.244 177.787 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -57.58 -41.58 81.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 119.244 0.929 . . . . 0.0 109.908 178.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -68.07 -53.18 27.44 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.618 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -46.34 84.96 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -179.404 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.45 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.8 t-160 -58.41 -44.71 89.13 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.0 m -63.17 -38.59 91.77 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.087 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.57 -37.57 88.01 Favored 'General case' 0 CA--C 1.498 -1.03 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.75 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.7 mt -58.95 -42.26 85.51 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.053 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 22.4 mmtt -64.9 -45.36 86.27 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 120.864 0.364 . . . . 0.0 111.7 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -66.9 -28.51 68.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.414 -178.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.96 -17.81 63.32 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 122.722 0.409 . . . . 0.0 111.912 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.8 mt -109.63 12.14 24.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.605 -176.732 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -53.25 128.29 27.54 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.3 t -60.31 -42.36 90.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.825 0.822 . . . . 0.0 109.672 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -71.88 -24.87 61.74 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.378 -1.283 . . . . 0.0 113.168 -177.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 46.5 m -156.34 72.7 5.0 Favored Pre-proline 0 C--O 1.244 0.814 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -176.068 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.93 144.66 43.55 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 115.95 -2.234 . . . . 0.0 112.484 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -137.23 102.04 4.71 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.114 0.483 . . . . 0.0 109.874 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -61.08 -47.33 94.05 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.882 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -178.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -57.26 -31.16 65.29 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 123.118 0.261 . . . . 0.0 110.497 -178.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -69.38 -40.88 77.14 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.403 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.26 -49.56 69.12 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.479 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 70.2 mt -56.89 -44.13 82.01 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -176.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -61.45 -39.14 89.75 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.681 0.753 . . . . 0.0 111.749 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -72.18 -46.58 55.77 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.372 0.606 . . . . 0.0 109.831 178.235 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.403 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.62 -48.67 71.92 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.925 178.335 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -60.84 -35.99 77.97 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -175.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.13 -47.08 53.73 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.145 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.03 -34.48 68.23 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.335 0.588 . . . . 0.0 110.153 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.51 -14.53 64.78 Favored Glycine 0 C--O 1.236 0.224 0 N-CA-C 115.339 0.896 . . . . 0.0 115.339 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 15.1 t -111.97 -16.92 13.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 117.767 0.783 . . . . 0.0 110.493 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.408 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.6 mt -63.88 150.8 44.13 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.213 -0.304 . . . . 0.0 110.947 -178.544 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.464 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.2 tt0 -79.51 84.53 5.37 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-O 122.6 1.19 . . . . 0.0 109.188 178.136 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.896 HG21 HD22 ' A' ' 546' ' ' LEU . 30.0 m -101.04 48.21 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.279 0 CA-C-O 123.367 1.556 . . . . 0.0 108.029 -178.244 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 13.7 t -67.79 171.86 6.03 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.1 m -49.23 -31.0 7.89 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -173.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -55.45 -44.1 76.06 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 122.292 -0.255 . . . . 0.0 111.558 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.464 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.6 -42.36 14.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.543 0 CA-C-O 121.683 0.754 . . . . 0.0 109.275 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.466 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.11 -40.86 82.26 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -174.273 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -72.48 -28.74 63.09 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.399 -175.694 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -88.6 -9.16 53.16 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 122.198 -0.314 . . . . 0.0 110.762 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -125.53 39.71 3.9 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.486 0.66 . . . . 0.0 111.402 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -62.78 -23.87 67.44 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.67 -31.46 72.69 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.995 0.902 . . . . 0.0 112.365 178.046 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.567 HG21 HD21 ' A' ' 475' ' ' LEU . 60.2 t -70.26 -41.76 78.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.02 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 42.0 t -63.39 -37.71 80.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.2 -34.11 77.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.593 177.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 88.0 m -76.59 -39.39 52.72 Favored 'General case' 0 C--O 1.219 -0.509 0 O-C-N 122.172 -0.33 . . . . 0.0 110.414 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.664 HD23 HD11 ' A' ' 526' ' ' ILE . 57.9 mt -59.16 -35.0 72.76 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.215 0.531 . . . . 0.0 110.734 178.94 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -63.47 -29.14 70.47 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 122.007 -0.433 . . . . 0.0 111.159 175.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -73.82 -42.72 60.49 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.664 HD11 HD23 ' A' ' 523' ' ' LEU . 1.5 pt -78.77 -23.06 12.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -178.238 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.37 -13.96 34.9 Favored 'General case' 0 C--O 1.214 -0.791 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 177.039 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -118.59 15.83 13.69 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.094 0.558 . . . . 0.0 111.401 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -69.46 116.93 10.44 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 122.889 0.476 . . . . 0.0 111.409 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -92.35 -16.44 26.0 Favored 'General case' 0 C--O 1.217 -0.605 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -177.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -69.5 -22.23 63.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.472 -178.49 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -150.38 126.27 10.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.584 0.231 . . . . 0.0 110.654 174.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -63.06 -49.29 75.13 Favored 'General case' 0 C--O 1.21 -0.979 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.049 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -57.14 -39.31 74.94 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.259 0.552 . . . . 0.0 111.94 -174.229 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.88 -45.35 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 122.057 -0.402 . . . . 0.0 110.024 176.727 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.2 ttp -67.29 -44.0 80.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 119.407 -0.33 . . . . 0.0 110.2 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -64.04 -47.4 80.35 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -70.3 -37.99 74.88 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 119.245 -0.982 . . . . 0.0 110.954 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.56 -40.93 84.42 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-O 121.83 0.824 . . . . 0.0 108.813 178.06 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.427 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.78 -51.11 66.31 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.144 -1.389 . . . . 0.0 113.921 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -43.75 84.83 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.93 -52.16 37.24 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.93 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.449 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -54.56 -46.04 73.59 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.583 0.23 . . . . 0.0 110.534 -177.457 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 41.3 m -64.67 -36.56 84.67 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.639 0.776 . . . . 0.0 111.443 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -63.73 -27.84 69.48 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.649 -0.657 . . . . 0.0 110.704 175.741 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.896 HD22 HG21 ' A' ' 508' ' ' VAL . 11.5 mt -74.47 -36.23 63.29 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -30.62 70.12 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.459 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--N 1.318 -0.79 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.888 178.296 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.4 m . . . . . 0 CA--C 1.52 -0.174 0 CA-C-O 121.132 0.491 . . . . 0.0 111.805 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 46.9 t -55.93 -47.01 80.51 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.974 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.42 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.2 pt-20 -66.63 -34.17 77.27 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -179.368 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -66.16 -40.27 90.41 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -71.46 -34.69 70.45 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.64 0.733 . . . . 0.0 110.342 -179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -57.12 -39.78 75.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.437 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -53.63 -38.52 64.15 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.938 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -72.96 -54.22 9.2 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.012 175.941 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.81 -48.07 76.04 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -61.85 -40.73 96.37 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 66.8 m -63.86 -41.07 97.87 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.612 179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.73 -41.92 95.59 Favored 'General case' 0 CA--C 1.5 -0.961 0 C-N-CA 120.858 -0.337 . . . . 0.0 111.017 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.73 -46.14 73.81 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.273 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.253 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -67.78 -39.52 84.08 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -68.48 -30.55 69.42 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 120.717 0.294 . . . . 0.0 110.621 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.17 -18.84 65.45 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.6 mt -105.35 12.09 32.03 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.345 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -54.82 130.56 41.43 Favored 'General case' 0 C--O 1.21 -1.006 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.1 t -63.93 -41.19 91.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-O 122.152 0.977 . . . . 0.0 109.063 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -68.64 -28.49 66.94 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.919 -1.492 . . . . 0.0 113.24 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 66.3 m -158.93 76.2 3.28 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.66 146.64 49.38 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 115.702 -2.399 . . . . 0.0 111.794 178.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -137.31 91.32 2.6 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.749 0.785 . . . . 0.0 110.14 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.4 HG12 ' H ' ' A' ' 493' ' ' VAL . 1.3 p -57.21 -46.97 84.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 -177.439 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -58.87 -30.97 68.13 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -177.681 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -70.2 -41.91 73.06 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.444 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.02 -49.46 72.3 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 176.56 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.7 mt -57.3 -42.61 82.11 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -176.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -65.17 -39.18 92.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.369 0.604 . . . . 0.0 111.407 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.62 -47.65 69.03 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.444 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.21 -44.78 79.83 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.389 177.638 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -66.8 -34.31 77.55 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 119.264 0.938 . . . . 0.0 113.493 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -69.1 -45.11 71.05 Favored 'General case' 0 C--O 1.225 -0.216 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 176.215 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.59 -33.37 66.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.543 0.687 . . . . 0.0 110.069 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.25 -16.17 64.34 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-O 119.181 -0.788 . . . . 0.0 114.656 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.7 t -114.82 -12.44 12.1 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.311 1.056 . . . . 0.0 110.815 179.346 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.1 mt -67.47 144.92 55.46 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.752 -0.593 . . . . 0.0 111.179 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.422 ' O ' HD13 ' A' ' 512' ' ' ILE . 2.2 mt-30 -76.44 84.35 3.17 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-O 122.684 1.231 . . . . 0.0 109.279 177.07 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.914 HG21 HD22 ' A' ' 546' ' ' LEU . 29.1 m -97.99 46.91 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 CA-C-O 122.596 1.189 . . . . 0.0 109.127 -178.283 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.7 t -67.41 172.84 4.5 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 46.1 m -49.32 -33.92 14.42 Favored 'General case' 0 C--O 1.218 -0.596 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -174.313 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -53.33 -44.86 68.78 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.422 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.35 -42.6 14.93 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.435 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.28 -39.17 78.54 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -175.196 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -70.26 -29.71 66.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.114 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -90.16 -2.45 58.07 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.345 -0.222 . . . . 0.0 110.95 177.295 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -129.61 45.48 2.8 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.759 0.79 . . . . 0.0 111.999 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.4 p -64.84 -28.53 69.62 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.731 -0.606 . . . . 0.0 112.515 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -67.04 -26.27 66.68 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.508 0.671 . . . . 0.0 111.885 178.017 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.84 -43.42 79.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 41.6 t -63.85 -35.43 73.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.63 -38.21 89.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 119.305 -0.378 . . . . 0.0 110.963 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.6 m -75.43 -39.24 59.13 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 118.999 0.818 . . . . 0.0 109.654 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.525 HD23 HD11 ' A' ' 526' ' ' ILE . 46.8 mt -57.57 -35.0 69.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.03 0.443 . . . . 0.0 111.394 178.395 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -64.66 -29.16 70.15 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.878 -0.514 . . . . 0.0 111.561 175.18 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -73.4 -49.02 29.27 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.622 0.248 . . . . 0.0 110.984 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.525 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -73.34 -21.9 19.01 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.963 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 -175.326 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -60.45 -18.35 50.72 Favored 'General case' 0 C--O 1.214 -0.785 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 176.639 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -118.81 19.37 13.14 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 122.911 0.484 . . . . 0.0 111.279 176.711 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -63.19 113.6 3.27 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 121.156 0.503 . . . . 0.0 111.842 -176.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -75.54 -30.97 59.91 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 115.686 1.736 . . . . 0.0 115.686 -176.009 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.65 -42.43 95.44 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.032 0.444 . . . . 0.0 112.159 -174.774 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -129.88 109.81 11.2 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.4 tptt -56.06 -42.47 76.7 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.938 178.964 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -55.7 -43.08 76.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.154 0.502 . . . . 0.0 111.795 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 69.2 t -57.99 -43.74 85.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 177.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -44.63 95.8 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.78 -47.74 77.02 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.605 -0.438 . . . . 0.0 112.013 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -68.59 -39.94 80.72 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.854 -178.407 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.42 -41.11 88.76 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.442 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.26 -48.33 78.63 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -42.15 95.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.253 0.549 . . . . 0.0 109.681 -179.408 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 77.3 t -70.57 -51.63 35.68 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.456 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -53.44 -45.26 69.4 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 122.526 0.33 . . . . 0.0 110.841 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 22.6 m -65.03 -36.91 85.9 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 122.925 0.49 . . . . 0.0 111.342 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 42.2 mtt85 -62.0 -28.95 69.93 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 121.672 -0.643 . . . . 0.0 110.661 176.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.914 HD22 HG21 ' A' ' 508' ' ' VAL . 5.5 mt -76.51 -31.72 57.84 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 -176.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 -31.64 72.48 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.81 177.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 16.2 m . . . . . 0 C--N 1.319 -0.746 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 177.017 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.7 m . . . . . 0 C--O 1.224 -0.287 0 CA-C-O 120.862 0.363 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.4 t -54.25 -45.91 67.88 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -65.03 -34.07 77.55 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.03 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -66.44 -41.36 89.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -73.21 -33.3 65.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.808 -176.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.476 HD21 HG21 ' A' ' 519' ' ' VAL . 5.1 tt -59.69 -35.49 74.6 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.631 178.05 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -58.12 -40.27 80.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 119.037 0.835 . . . . 0.0 110.053 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -65.32 -55.83 16.09 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.403 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -45.8 90.37 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -177.194 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.445 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.9 t-160 -58.61 -42.72 88.82 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 53.9 m -64.63 -39.08 93.07 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 121.197 -0.201 . . . . 0.0 111.434 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.415 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.3 mm-40 -63.54 -37.67 88.18 Favored 'General case' 0 CA--C 1.508 -0.653 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.6 178.589 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.6 mt -59.17 -43.02 88.55 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -63.45 -44.92 93.11 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.75 -32.4 73.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.79 0.329 . . . . 0.0 110.979 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.58 -17.34 64.6 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.3 mt -109.69 12.06 24.33 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -55.29 132.4 47.81 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 177.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.73 -41.45 92.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 122.316 1.055 . . . . 0.0 108.723 177.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -66.42 -31.22 71.85 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 113.519 -1.673 . . . . 0.0 113.152 -178.645 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 11.1 t -160.48 76.97 2.65 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -175.398 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -73.99 144.95 34.94 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 116.68 -1.747 . . . . 0.0 112.716 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -137.34 102.24 4.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.685 0.755 . . . . 0.0 110.88 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.446 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.5 OUTLIER -60.11 -45.39 95.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -179.098 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -59.66 -31.9 69.97 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -70.1 -41.13 74.43 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -177.359 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -48.75 73.1 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 176.125 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 87.5 mt -56.94 -44.59 82.66 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -176.369 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -63.16 -39.04 93.51 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.799 0.809 . . . . 0.0 111.446 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.71 -47.27 63.74 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.448 0.642 . . . . 0.0 109.934 178.693 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.59 -48.26 75.13 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.641 178.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.36 -36.6 82.73 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -175.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -70.05 -45.7 66.55 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -35.77 70.42 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.295 0.569 . . . . 0.0 110.054 -179.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.91 -17.65 67.75 Favored Glycine 0 C--O 1.244 0.762 0 N-CA-C 115.288 0.875 . . . . 0.0 115.288 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.9 t -108.56 -13.43 14.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.512 0.656 . . . . 0.0 109.822 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.1 mt -69.99 149.47 47.7 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.466 ' O ' HD13 ' A' ' 512' ' ' ILE . 35.4 tt0 -79.82 84.39 5.62 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-O 122.56 1.172 . . . . 0.0 109.281 177.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.941 HG21 HD22 ' A' ' 546' ' ' LEU . 27.3 m -98.16 47.93 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 CA-C-O 123.247 1.499 . . . . 0.0 107.608 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.9 t -66.31 173.68 3.09 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 113.807 -1.542 . . . . 0.0 107.167 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.3 m -49.38 -34.67 16.69 Favored 'General case' 0 C--O 1.215 -0.713 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -54.28 -45.15 72.43 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 177.623 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -86.52 -40.0 13.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 CA-C-O 121.691 0.758 . . . . 0.0 109.324 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.4 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.79 -38.16 81.13 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -175.979 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -67.1 -35.0 78.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.348 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -86.83 -6.86 58.67 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.116 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -128.74 45.64 2.75 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.914 0.864 . . . . 0.0 112.924 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.9 p -65.0 -24.23 67.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.357 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.08 -33.84 76.68 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.56 1.172 . . . . 0.0 112.231 178.322 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.476 HG21 HD21 ' A' ' 475' ' ' LEU . 86.1 t -68.43 -43.45 84.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.3 t -63.43 -37.1 78.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.36 -36.68 84.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.582 177.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.6 m -75.58 -39.73 57.64 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 118.215 0.461 . . . . 0.0 109.797 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.59 HD23 HD11 ' A' ' 526' ' ' ILE . 55.4 mt -58.19 -34.88 70.84 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.921 0.391 . . . . 0.0 111.257 178.651 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -64.22 -29.07 70.19 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.858 -0.526 . . . . 0.0 111.317 175.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -73.76 -46.02 48.27 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.72 0.295 . . . . 0.0 111.401 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.59 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -77.49 -20.6 14.07 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.164 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -176.956 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.466 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.21 -15.6 47.74 Favored 'General case' 0 C--O 1.211 -0.957 0 O-C-N 121.952 -0.467 . . . . 0.0 112.156 176.056 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -119.21 19.33 12.88 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.155 0.582 . . . . 0.0 111.456 176.067 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -63.75 116.25 5.55 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.276 0.56 . . . . 0.0 112.294 -175.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -83.18 -27.99 29.65 Favored 'General case' 0 C--O 1.216 -0.667 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -177.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.26 -27.38 66.28 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.981 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -147.97 114.94 6.12 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 177.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -63.12 -38.27 90.5 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -175.779 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -58.77 -38.94 79.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.919 0.39 . . . . 0.0 111.481 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.6 t -58.47 -44.64 89.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 177.578 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 3.3 ttp -64.22 -42.03 96.76 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 110.445 -0.206 . . . . 0.0 110.445 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.3 -49.43 74.04 Favored 'General case' 0 C--N 1.32 -0.713 0 O-C-N 123.191 0.307 . . . . 0.0 111.164 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.6 tptt -71.33 -38.05 71.7 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 118.868 -1.133 . . . . 0.0 111.335 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.7 -40.91 85.02 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.466 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.7 -51.12 66.42 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.748 -1.115 . . . . 0.0 113.904 178.263 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -44.03 90.16 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 -179.437 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.7 t -67.4 -51.23 54.56 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.957 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.811 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -54.26 -44.67 72.0 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -178.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 28.1 m -65.28 -39.21 92.26 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.132 0.573 . . . . 0.0 111.3 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 43.1 mtt-85 -57.95 -31.74 67.13 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 121.844 -0.535 . . . . 0.0 110.109 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.941 HD22 HG21 ' A' ' 508' ' ' VAL . 4.1 mt -76.62 -31.79 57.63 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -175.649 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 -38.89 91.25 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.772 177.386 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 C--N 1.322 -0.628 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 178.169 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 5.5 m . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 120.781 0.324 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -53.35 -45.54 56.68 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.956 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -33.62 75.98 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -178.825 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -70.59 -40.37 73.27 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -74.1 -31.66 62.9 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.708 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.34 -39.24 66.89 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.239 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -53.21 -38.74 63.14 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.4 0.148 . . . . 0.0 111.4 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -67.89 -58.22 4.93 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.332 176.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -46.48 88.87 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -174.414 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.2 t-160 -59.29 -41.15 88.27 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 59.5 m -65.64 -39.32 91.29 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 118.184 0.447 . . . . 0.0 111.46 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.476 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 10.9 mm-40 -63.28 -38.03 89.55 Favored 'General case' 0 CA--C 1.506 -0.721 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.92 178.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.63 -43.13 86.74 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.121 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 179.253 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 53.9 mmtt -63.18 -45.6 91.04 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.04 -33.1 75.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.885 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.78 -18.48 65.39 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 30.9 mt -108.45 12.02 26.51 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 -177.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 47.3 mttt -55.18 129.18 37.25 Favored 'General case' 0 C--O 1.21 -0.985 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 176.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 53.8 t -62.92 -41.81 94.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-O 122.261 1.029 . . . . 0.0 108.638 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -68.51 -26.77 65.62 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.592 -1.64 . . . . 0.0 113.573 -179.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 26.8 m -158.12 73.04 4.02 Favored Pre-proline 0 N--CA 1.473 0.722 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.21 145.14 34.31 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 115.728 -2.381 . . . . 0.0 112.79 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -137.23 97.78 3.57 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.714 0.769 . . . . 0.0 110.553 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.436 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.7 OUTLIER -57.39 -46.57 85.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -179.412 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -58.42 -32.1 68.35 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -71.19 -40.64 71.09 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 -176.767 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.459 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -64.3 -49.43 71.83 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 175.792 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.6 mt -56.84 -43.28 80.94 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -176.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -65.54 -38.07 88.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.471 0.653 . . . . 0.0 111.795 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.476 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -66.04 -48.52 70.81 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.818 0.818 . . . . 0.0 109.33 177.935 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.459 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.23 -43.43 82.87 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.059 178.581 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -60.6 -37.47 81.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 119.035 0.834 . . . . 0.0 112.476 -177.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.02 -41.45 59.3 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.518 -0.873 . . . . 0.0 108.84 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.7 -34.01 69.0 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.422 0.629 . . . . 0.0 110.108 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.38 -19.31 66.42 Favored Glycine 0 N--CA 1.452 -0.29 0 N-CA-C 114.915 0.726 . . . . 0.0 114.915 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.7 t -112.41 -13.81 13.35 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.102 0.951 . . . . 0.0 110.925 -178.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.72 144.66 56.76 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.817 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.441 ' O ' HD13 ' A' ' 512' ' ' ILE . 29.5 tt0 -77.84 84.78 4.14 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-O 122.814 1.293 . . . . 0.0 109.561 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.919 HG21 HD22 ' A' ' 546' ' ' LEU . 27.6 m -97.22 48.11 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-O 122.862 1.315 . . . . 0.0 108.281 -178.742 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.6 t -66.62 172.75 3.9 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 22.5 m -49.22 -33.28 12.21 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -174.275 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -55.44 -44.32 76.22 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.323 -0.236 . . . . 0.0 111.442 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.441 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -86.13 -42.06 15.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.455 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.41 -37.28 80.35 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -174.909 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -67.82 -31.75 71.82 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.524 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -89.73 -4.71 57.57 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 121.016 -0.273 . . . . 0.0 110.599 178.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -128.48 46.32 2.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.596 0.712 . . . . 0.0 112.24 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 25.7 p -65.59 -25.6 67.47 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 121.455 -0.778 . . . . 0.0 112.257 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.71 -29.08 68.24 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 122.682 1.229 . . . . 0.0 112.405 178.247 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 79.5 t -68.62 -44.74 82.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.4 t -63.86 -37.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.93 -35.35 79.82 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.867 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 92.3 m -77.46 -38.85 48.44 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 118.749 0.704 . . . . 0.0 109.41 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.554 HD23 HD11 ' A' ' 526' ' ' ILE . 43.8 mt -58.21 -35.21 71.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.06 0.457 . . . . 0.0 111.117 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -64.5 -29.11 70.15 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.923 -0.486 . . . . 0.0 111.486 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -74.29 -42.12 60.07 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.006 0.372 . . . . 0.0 112.006 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.554 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.84 -22.7 12.88 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.002 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 -178.047 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -16.87 55.99 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 176.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -118.74 19.34 13.19 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 123.323 0.649 . . . . 0.0 111.336 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -67.5 110.75 3.78 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -73.82 -30.34 62.65 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -176.784 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.1 -41.85 97.12 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -174.585 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -131.53 109.29 10.16 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -178.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -54.99 -43.34 73.46 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.97 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -55.03 -42.76 73.0 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.995 0.426 . . . . 0.0 111.999 -177.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 74.7 t -58.14 -44.46 87.57 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -62.53 -44.61 95.92 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.07 -47.16 78.25 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.38 -0.528 . . . . 0.0 112.185 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.0 tptt -68.67 -39.43 80.63 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.295 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.5 -40.23 86.39 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 121.59 0.709 . . . . 0.0 109.113 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -64.49 -48.95 73.26 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.703 -1.135 . . . . 0.0 113.113 179.181 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -42.74 90.74 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.7 t -69.45 -52.01 36.71 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.912 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.276 -178.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -54.0 -46.07 71.65 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 122.291 0.236 . . . . 0.0 110.661 -176.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 17.3 m -65.97 -35.28 80.15 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 122.884 0.474 . . . . 0.0 111.026 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -61.74 -29.69 70.28 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.775 -0.578 . . . . 0.0 110.154 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.919 HD22 HG21 ' A' ' 508' ' ' VAL . 8.6 mt -76.52 -32.13 58.09 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 -175.232 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.05 -28.89 69.92 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.601 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 23.0 m . . . . . 0 C--N 1.315 -0.916 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.336 176.691 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.0 m . . . . . 0 C--O 1.224 -0.242 0 CA-C-O 120.924 0.393 . . . . 0.0 111.5 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.418 HG13 ' HB3' ' A' ' 506' ' ' LEU . 40.1 t -54.16 -47.92 66.53 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 O-C-N 122.027 -0.421 . . . . 0.0 111.702 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.411 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.1 pt-20 -61.69 -34.18 75.3 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -178.347 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.13 -42.24 80.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 122.237 1.018 . . . . 0.0 108.46 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -71.65 -35.32 70.33 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.469 -177.64 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.452 HD21 HG21 ' A' ' 519' ' ' VAL . 4.6 tt -58.15 -35.38 71.45 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.72 178.408 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -56.7 -42.15 78.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 118.966 0.803 . . . . 0.0 109.778 177.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -68.37 -53.8 21.51 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.727 178.257 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -46.15 83.69 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 112.284 0.475 . . . . 0.0 112.284 -178.234 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.46 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.3 t-160 -58.09 -44.72 87.76 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.7 m -63.14 -38.22 90.31 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.437 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.3 mm-40 -64.66 -37.43 87.54 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.43 178.423 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.1 mt -58.92 -43.42 88.56 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.7 mmtt -63.66 -42.14 98.12 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -66.95 -34.69 78.32 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 120.788 0.327 . . . . 0.0 110.583 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -16.12 63.94 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 36.4 mt -111.94 12.08 20.72 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -58.56 133.24 55.66 Favored 'General case' 0 CA--C 1.489 -1.379 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 15.7 m -69.23 -16.13 20.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.022 177.682 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -91.89 -23.53 19.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.949 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 50.6 m -161.15 73.55 2.62 Favored Pre-proline 0 N--CA 1.469 0.494 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -175.577 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.35 142.55 33.65 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 113.822 -3.652 . . . . 0.0 112.381 178.388 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -137.36 101.86 4.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.589 0.709 . . . . 0.0 110.532 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.452 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.4 OUTLIER -57.54 -45.4 86.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.015 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 13.2 pttt -59.53 -32.32 70.2 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-O 121.718 0.77 . . . . 0.0 109.605 -176.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -71.53 -39.63 70.6 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.064 -176.563 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.425 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -66.71 -49.15 66.97 Favored 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.889 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 91.4 mt -56.9 -43.3 81.21 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 111.519 0.192 . . . . 0.0 111.519 -176.839 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -65.89 -33.23 75.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.418 0.628 . . . . 0.0 112.204 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.437 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -72.62 -47.06 50.9 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.671 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.425 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.53 -45.87 80.9 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.439 179.434 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -60.46 -36.32 77.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 119.063 0.847 . . . . 0.0 112.688 -176.67 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.36 -47.32 43.23 Favored 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.76 -35.01 68.14 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.183 0.516 . . . . 0.0 110.768 -178.372 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.75 -18.05 69.88 Favored Glycine 0 C--O 1.241 0.592 0 N-CA-C 115.156 0.822 . . . . 0.0 115.156 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.0 t -108.63 -14.16 14.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 117.554 0.677 . . . . 0.0 110.059 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.418 ' HB3' HG13 ' A' ' 471' ' ' VAL . 3.4 mt -67.82 148.49 51.13 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.417 ' O ' HD13 ' A' ' 512' ' ' ILE . 32.1 tt0 -79.09 84.25 5.1 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-O 122.734 1.254 . . . . 0.0 108.785 177.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.959 HG21 HD22 ' A' ' 546' ' ' LEU . 30.3 m -98.92 49.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.353 0 CA-C-O 123.133 1.444 . . . . 0.0 107.527 -178.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.4 t -67.1 173.15 3.94 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 34.4 m -49.32 -32.37 10.99 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -174.055 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.53 -44.46 76.72 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 177.698 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.417 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -88.05 -42.52 15.01 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 CA-C-O 121.62 0.724 . . . . 0.0 109.264 -179.152 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.477 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.48 -40.08 81.76 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -175.396 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -70.21 -31.05 68.32 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.191 -177.091 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -88.65 -7.85 55.64 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.397 178.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -126.29 40.85 3.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.564 0.697 . . . . 0.0 111.745 -178.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 11.6 p -62.66 -24.02 67.41 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 -179.144 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.4 -31.09 72.15 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.557 0.694 . . . . 0.0 112.102 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.46 HG22 ' CG ' ' A' ' 479' ' ' HIS . 24.3 t -70.92 -41.99 77.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 38.3 t -62.91 -38.46 81.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.48 -32.59 74.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.613 177.89 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.4 m -79.68 -39.38 31.46 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.479 HD23 HD11 ' A' ' 526' ' ' ILE . 37.1 mt -58.27 -35.65 72.1 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.199 0.523 . . . . 0.0 111.069 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -63.52 -29.09 70.41 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 122.117 -0.365 . . . . 0.0 111.412 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -74.07 -44.3 54.61 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 122.318 -0.239 . . . . 0.0 111.637 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.479 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -78.81 -19.96 13.02 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -176.997 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.86 -13.44 44.95 Favored 'General case' 0 C--O 1.212 -0.896 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 176.542 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -120.88 19.38 11.74 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 122.999 0.52 . . . . 0.0 111.505 176.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -64.98 118.82 9.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.111 0.482 . . . . 0.0 112.183 -177.043 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -83.79 -29.7 27.18 Favored 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -177.36 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.12 99.39 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.32 0.581 . . . . 0.0 111.488 -174.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.9 m120 -132.9 111.61 11.2 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -60.32 -36.53 78.13 Favored 'General case' 0 C--O 1.21 -0.993 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.793 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -57.1 -42.3 80.52 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.241 0.543 . . . . 0.0 112.138 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.4 t -58.5 -43.08 86.13 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.117 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 5.3 ttp -64.8 -40.82 95.86 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -63.87 -51.55 64.06 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -70.34 -38.79 74.91 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 119.289 -0.964 . . . . 0.0 111.751 -177.729 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.79 -39.4 80.96 Favored 'General case' 0 C--O 1.212 -0.878 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.421 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.71 -48.77 70.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.518 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -42.25 91.87 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.1 t -70.4 -50.29 47.08 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.452 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -55.93 -44.97 78.84 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.643 0.258 . . . . 0.0 110.36 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 19.1 m -67.63 -33.64 75.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.339 0.59 . . . . 0.0 110.954 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 10.9 mtt85 -61.44 -28.52 69.33 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 121.78 -0.575 . . . . 0.0 109.932 175.069 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.959 HD22 HG21 ' A' ' 508' ' ' VAL . 11.0 mt -76.68 -35.22 58.06 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 -175.549 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -27.74 69.35 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.395 177.939 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 C--N 1.316 -0.885 0 CA-C-N 114.693 -1.14 . . . . 0.0 111.739 177.886 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.7 m . . . . . 0 C--O 1.223 -0.311 0 CA-C-O 120.924 0.392 . . . . 0.0 111.335 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.416 HG13 ' HB3' ' A' ' 506' ' ' LEU . 25.7 t -53.18 -48.63 54.12 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -34.09 77.16 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -66.17 -39.57 89.85 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -74.33 -35.87 63.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.03 -178.192 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.496 HD21 HG21 ' A' ' 519' ' ' VAL . 5.3 tt -59.03 -35.51 73.43 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.531 177.737 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -56.38 -41.03 75.57 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.287 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -69.64 -53.22 19.76 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.43 -46.35 83.65 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.015 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -59.39 -41.82 90.26 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.6 m -64.66 -41.16 96.28 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.289 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.472 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 16.3 mm-40 -62.79 -41.94 99.49 Favored 'General case' 0 CA--C 1.503 -0.841 0 CA-C-N 117.964 0.347 . . . . 0.0 110.648 178.245 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.93 -46.9 76.48 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.206 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -67.47 -37.52 83.04 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -67.41 -32.61 73.62 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.77 0.319 . . . . 0.0 110.265 177.768 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.34 -17.8 64.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 179.171 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 31.6 mt -105.84 12.06 31.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 2.9 mttt -54.81 129.01 35.56 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 176.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.27 -40.46 89.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 CA-C-O 122.809 1.29 . . . . 0.0 107.852 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -65.12 -28.48 69.46 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.81 -1.996 . . . . 0.0 113.441 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 69.5 m -162.26 75.45 2.17 Favored Pre-proline 0 N--CA 1.474 0.73 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -73.5 143.75 35.01 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 114.741 -3.039 . . . . 0.0 112.605 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -137.21 100.91 4.39 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.398 0.618 . . . . 0.0 110.09 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -59.5 -46.72 92.64 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.891 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -57.11 -32.06 65.92 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -69.9 -40.43 75.63 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 119.868 -0.733 . . . . 0.0 109.162 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.421 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.01 -48.33 74.3 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.033 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.1 mt -56.96 -44.38 82.55 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 117.944 0.338 . . . . 0.0 111.855 -176.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.2 t30 -61.6 -38.92 89.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.797 0.808 . . . . 0.0 111.541 179.203 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.72 -48.55 59.11 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.5 0.667 . . . . 0.0 109.791 178.155 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.421 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.44 -48.51 71.62 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.162 178.708 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.99 -35.82 79.65 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -175.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -46.73 61.68 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 176.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.04 -34.27 68.05 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.368 0.604 . . . . 0.0 110.247 -178.628 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.17 -17.47 68.08 Favored Glycine 0 C--O 1.241 0.533 0 N-CA-C 115.101 0.801 . . . . 0.0 115.101 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.8 t -110.99 -12.06 14.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 117.867 0.834 . . . . 0.0 110.081 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.416 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.1 mt -69.63 147.48 50.61 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 121.917 -0.489 . . . . 0.0 110.057 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.414 ' O ' HD13 ' A' ' 512' ' ' ILE . 36.1 tt0 -78.73 84.48 4.81 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-O 122.83 1.3 . . . . 0.0 108.965 177.427 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.892 HG21 HD22 ' A' ' 546' ' ' LEU . 28.4 m -99.05 46.32 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 -179.397 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.1 t -66.16 169.69 6.73 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 -177.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 22.9 m -49.29 -29.4 5.88 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 114.266 1.209 . . . . 0.0 114.266 -174.179 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -55.62 -47.53 76.42 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.309 -0.244 . . . . 0.0 111.322 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.414 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -86.03 -39.84 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 CA-C-O 121.424 0.63 . . . . 0.0 109.513 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.442 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.92 -36.53 77.2 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -175.658 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -66.64 -32.94 74.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.786 0.803 . . . . 0.0 111.384 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -92.5 -1.13 57.18 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.997 -1.002 . . . . 0.0 111.753 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -132.29 43.25 3.03 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.663 0.744 . . . . 0.0 112.457 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 21.2 p -64.44 -25.57 68.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.14 -32.2 73.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.725 0.774 . . . . 0.0 112.354 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.496 HG21 HD21 ' A' ' 475' ' ' LEU . 61.5 t -68.39 -41.34 83.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.6 t -63.39 -37.01 78.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 178.417 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.72 -38.22 89.63 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.535 177.472 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 99.2 m -74.85 -38.11 62.06 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 118.5 0.591 . . . . 0.0 110.455 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.689 HD23 HD11 ' A' ' 526' ' ' ILE . 65.1 mt -58.82 -34.15 71.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.98 0.419 . . . . 0.0 111.034 178.21 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -65.08 -29.19 70.05 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.755 -0.59 . . . . 0.0 111.26 175.262 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -73.14 -42.73 62.54 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 122.239 -0.288 . . . . 0.0 111.441 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.689 HD11 HD23 ' A' ' 523' ' ' LEU . 2.2 pt -78.87 -24.13 13.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.04 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.423 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.59 -14.09 38.72 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 121.736 -0.602 . . . . 0.0 112.187 176.611 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -118.72 18.69 13.35 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.357 0.663 . . . . 0.0 111.516 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -68.74 106.26 2.59 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -175.736 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -75.97 -23.23 55.33 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.54 -24.4 64.63 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -177.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -151.67 126.18 9.47 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.511 -0.475 . . . . 0.0 112.062 174.357 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 46.4 tptt -62.21 -50.13 73.0 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.408 -178.425 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -57.82 -39.82 78.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.251 0.548 . . . . 0.0 111.455 -174.05 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 54.8 t -56.1 -45.36 80.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 176.829 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.8 ttp -67.41 -43.41 81.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.542 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -64.24 -47.64 78.89 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.0 tptt -69.48 -37.94 77.47 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.669 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 539' ' ' ALA . . . . . 0.419 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -58.82 -41.57 87.17 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.27 -51.09 67.57 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.599 -1.182 . . . . 0.0 113.322 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -44.71 90.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 -179.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.5 t -67.75 -50.0 64.45 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.998 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.179 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -54.58 -44.58 73.12 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.6 m -65.46 -39.04 91.54 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 122.925 0.49 . . . . 0.0 111.317 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 35.8 mtt-85 -57.74 -31.74 66.76 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 121.874 -0.516 . . . . 0.0 110.447 175.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.892 HD22 HG21 ' A' ' 508' ' ' VAL . 3.3 mt -76.69 -31.7 57.4 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.645 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -37.83 88.62 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.45 178.267 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--N 1.319 -0.721 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.502 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 C--O 1.22 -0.455 0 CA-C-O 120.822 0.344 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.411 HG13 ' HB3' ' A' ' 506' ' ' LEU . 51.8 t -54.31 -47.55 68.82 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.947 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.874 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.433 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.7 pt-20 -63.38 -33.9 76.56 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 122.525 0.33 . . . . 0.0 111.781 -178.655 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -68.36 -41.56 80.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 178.413 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -72.74 -32.72 65.89 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.842 -176.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.445 HD23 HD21 ' A' ' 503' ' ' LEU . 1.2 tm? -56.35 -35.61 67.85 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.698 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -54.7 -39.95 68.68 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.952 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 39.1 tttt -66.46 -54.3 25.68 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 176.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -47.36 85.66 Favored 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -176.282 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -61.01 -40.57 94.06 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 66.1 m -64.04 -41.93 97.24 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.424 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -63.91 -42.69 97.35 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-O 119.426 -0.321 . . . . 0.0 111.349 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.43 -46.44 70.48 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.272 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -68.09 -38.42 82.33 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -176.858 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -68.37 -31.19 70.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.709 0.29 . . . . 0.0 110.245 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -19.17 65.71 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.5 mt -105.84 12.15 31.1 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -55.62 129.41 38.96 Favored 'General case' 0 C--O 1.209 -1.038 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 177.218 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.7 t -63.15 -40.64 89.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 122.363 1.078 . . . . 0.0 108.504 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -68.43 -27.14 65.92 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 113.491 -1.686 . . . . 0.0 113.148 -178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 49.4 m -159.43 74.0 3.29 Favored Pre-proline 0 N--CA 1.47 0.563 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -176.495 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.45 145.93 43.59 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 114.701 -3.066 . . . . 0.0 112.372 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -137.3 91.74 2.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.523 0.678 . . . . 0.0 110.154 -176.015 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.414 HG12 ' H ' ' A' ' 493' ' ' VAL . 1.1 p -57.37 -46.02 85.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -177.462 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -58.06 -31.36 66.98 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 120.843 0.354 . . . . 0.0 110.089 -177.889 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -70.9 -42.08 70.42 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 -177.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.486 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -63.26 -49.44 74.09 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 176.602 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 80.8 mt -57.01 -42.89 81.2 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -176.383 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -66.01 -38.35 88.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.297 0.57 . . . . 0.0 111.468 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -65.77 -48.25 72.45 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.658 0.742 . . . . 0.0 109.22 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.486 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.76 -44.52 81.85 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.552 177.425 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -62.41 -36.97 84.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 119.161 0.891 . . . . 0.0 112.32 -177.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -71.77 -43.92 64.9 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.445 HD21 HD23 ' A' ' 475' ' ' LEU . 0.8 OUTLIER -60.8 -31.71 71.09 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.399 0.619 . . . . 0.0 110.246 -179.111 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.82 -17.41 62.84 Favored Glycine 0 C--O 1.24 0.517 0 CA-C-O 119.507 -0.607 . . . . 0.0 114.494 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 12.2 t -114.85 -13.36 11.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.742 0.771 . . . . 0.0 111.048 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.411 ' HB3' HG13 ' A' ' 471' ' ' VAL . 2.2 mt -67.0 146.41 54.39 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.197 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.439 ' O ' HD13 ' A' ' 512' ' ' ILE . 35.5 tt0 -77.67 84.22 4.02 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 122.515 1.15 . . . . 0.0 110.17 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.892 HG21 HD22 ' A' ' 546' ' ' LEU . 26.9 m -98.27 47.56 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 CA-C-O 122.942 1.353 . . . . 0.0 109.079 -178.398 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.2 t -66.94 173.61 3.53 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 20.1 m -49.38 -32.99 12.61 Favored 'General case' 0 C--O 1.214 -0.794 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -173.939 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -55.44 -43.9 75.8 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 177.612 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.439 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -87.14 -41.85 14.94 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 CA-C-O 121.518 0.675 . . . . 0.0 109.32 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.455 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.92 -38.08 81.32 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -174.64 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -67.62 -32.91 73.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.716 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -88.69 -7.38 56.42 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.671 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -123.49 40.58 3.69 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.122 0.487 . . . . 0.0 111.017 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 12.0 p -62.63 -29.53 70.69 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.638 -0.664 . . . . 0.0 112.766 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -63.17 -29.21 70.61 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.527 0.68 . . . . 0.0 111.633 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.402 HG21 HD21 ' A' ' 475' ' ' LEU . 46.9 t -71.45 -43.79 72.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 43.1 t -61.95 -39.99 85.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.02 76.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.293 177.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.8 m -77.57 -38.55 48.17 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 118.883 0.765 . . . . 0.0 109.939 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.704 HD23 HD11 ' A' ' 526' ' ' ILE . 55.1 mt -58.66 -34.32 71.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.148 0.499 . . . . 0.0 110.208 177.443 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 5.4 mtpp -61.73 -34.36 75.68 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.008 -0.432 . . . . 0.0 111.66 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -69.71 -45.51 68.08 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.728 0.299 . . . . 0.0 111.769 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.704 HD11 HD23 ' A' ' 523' ' ' LEU . 3.9 pt -78.42 -22.59 13.29 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -175.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.469 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -64.36 -12.28 40.82 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 121.903 -0.498 . . . . 0.0 112.168 175.367 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -121.38 18.95 11.39 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 122.604 0.361 . . . . 0.0 111.51 175.121 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -67.92 118.4 11.07 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -176.789 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -85.19 -26.15 26.94 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -177.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.63 -41.59 98.24 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.174 0.511 . . . . 0.0 111.367 -175.963 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -130.93 109.92 10.89 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.82 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -58.18 -39.31 78.61 Favored 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.801 178.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -56.54 -42.79 79.09 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.385 0.612 . . . . 0.0 111.262 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 69.0 t -59.89 -44.06 93.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.801 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 29.3 ttm -57.98 -48.01 81.28 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 122.61 0.364 . . . . 0.0 110.4 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.68 -47.15 76.42 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -72.12 -37.31 69.5 Favored 'General case' 0 CA--C 1.513 -0.468 0 C-N-CA 118.148 -1.421 . . . . 0.0 110.778 -176.224 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 539' ' ' ALA . . . . . 0.405 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -59.11 -40.87 86.68 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 178.065 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.4 -49.92 71.89 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.04 -43.8 91.69 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 -178.823 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 65.1 t -69.18 -50.06 56.14 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.971 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.493 -176.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -54.31 -44.82 72.34 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.11 -0.329 . . . . 0.0 110.11 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.4 m -66.38 -36.22 82.31 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.914 0.486 . . . . 0.0 111.291 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 41.1 mtt-85 -60.47 -28.92 68.71 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.735 -0.603 . . . . 0.0 110.329 175.387 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.892 HD22 HG21 ' A' ' 508' ' ' VAL . 7.8 mt -76.77 -33.42 58.07 Favored 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -175.07 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -29.64 70.31 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.755 178.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--N 1.317 -0.828 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.173 176.913 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.9 m . . . . . 0 C--O 1.224 -0.238 0 CA-C-O 120.942 0.401 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.403 HG13 ' HB3' ' A' ' 506' ' ' LEU . 43.1 t -54.65 -48.02 72.15 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.14 0 O-C-N 122.042 -0.411 . . . . 0.0 111.824 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -60.25 -34.25 73.44 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -68.77 -42.89 76.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 122.166 0.984 . . . . 0.0 108.603 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -72.57 -34.84 67.75 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.332 -176.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.551 HD21 HG21 ' A' ' 519' ' ' VAL . 2.1 tt -57.0 -40.3 76.33 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.364 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -60.35 -37.18 79.87 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.59 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -68.72 -53.44 22.06 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.828 176.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -45.33 82.81 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 118.557 0.617 . . . . 0.0 112.191 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.426 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.4 t-160 -57.44 -43.78 84.18 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 48.7 m -64.63 -38.5 91.21 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.422 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 50.5 mm-40 -65.47 -35.8 81.97 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.046 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.4 -42.34 83.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.024 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -64.16 -45.25 89.29 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -65.13 -33.41 75.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.272 -178.207 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.83 -18.05 65.07 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 29.8 mt -108.56 12.08 26.26 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -177.537 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -54.49 129.69 36.94 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.8 t -62.94 -41.17 91.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 122.612 1.196 . . . . 0.0 107.819 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -65.63 -28.03 68.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.052 -1.886 . . . . 0.0 113.549 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 5.7 m -159.63 72.7 3.28 Favored Pre-proline 0 N--CA 1.473 0.691 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -176.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -73.4 143.01 34.18 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 114.281 -3.346 . . . . 0.0 112.509 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -137.22 100.44 4.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.581 0.705 . . . . 0.0 109.976 -178.155 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.7 -47.88 91.13 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.889 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -177.97 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -57.04 -32.05 65.78 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.9 ttt180 -68.84 -40.25 79.53 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 -177.476 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.4 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.85 -49.81 69.12 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 175.696 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 60.9 mt -56.54 -44.36 80.81 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -175.714 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -62.82 -39.95 95.87 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.716 0.769 . . . . 0.0 111.206 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.422 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -70.88 -45.68 63.97 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 121.745 -0.597 . . . . 0.0 110.0 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.4 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.58 -49.51 70.2 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.594 177.202 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -61.89 -36.06 80.16 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -175.672 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.38 -46.44 66.92 Favored 'General case' 0 C--O 1.223 -0.337 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.94 -33.64 67.2 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.498 0.666 . . . . 0.0 109.951 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.23 -17.53 68.27 Favored Glycine 0 N--CA 1.452 -0.288 0 N-CA-C 115.115 0.806 . . . . 0.0 115.115 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.2 t -111.87 -11.44 13.91 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.989 0.895 . . . . 0.0 110.241 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.403 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.2 mt -69.37 148.67 49.33 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 121.896 -0.503 . . . . 0.0 109.822 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.443 ' O ' HD13 ' A' ' 512' ' ' ILE . 35.7 tt0 -78.25 84.15 4.47 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-O 122.49 1.138 . . . . 0.0 108.864 177.299 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.926 HG21 HD22 ' A' ' 546' ' ' LEU . 27.2 m -98.55 47.22 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-O 123.21 1.481 . . . . 0.0 107.708 -178.971 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.3 t -66.8 171.93 4.82 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 -178.03 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.7 m -49.15 -33.69 12.65 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -173.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -55.62 -44.79 77.38 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 176.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 507' ' ' GLN . 3.9 mp -83.63 -42.48 17.48 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 CA-C-O 122.036 0.922 . . . . 0.0 108.611 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -37.7 76.56 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -176.26 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -67.11 -33.44 75.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.425 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -89.35 -9.74 49.27 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.248 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -125.08 41.7 3.45 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.516 0.674 . . . . 0.0 112.002 -175.973 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 22.8 p -62.24 -27.43 68.99 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -66.95 -26.54 66.88 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.551 HG21 HD21 ' A' ' 475' ' ' LEU . 43.0 t -71.71 -42.26 70.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.2 t -63.33 -37.35 79.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.57 -34.46 77.86 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.872 177.173 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.1 m -77.27 -39.84 46.72 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 118.072 0.396 . . . . 0.0 110.203 179.47 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 526' ' ' ILE . 54.1 mt -58.24 -35.37 71.61 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.082 0.467 . . . . 0.0 110.929 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -63.32 -29.01 70.4 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.062 -0.399 . . . . 0.0 111.348 175.219 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -74.58 -42.95 57.83 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.648 HD11 HD23 ' A' ' 523' ' ' LEU . 1.3 pt -78.78 -23.38 13.0 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.866 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.4 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -60.8 -17.13 47.63 Favored 'General case' 0 C--O 1.214 -0.784 0 O-C-N 121.994 -0.442 . . . . 0.0 111.955 176.406 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -118.68 19.13 13.3 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.01 0.524 . . . . 0.0 111.386 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -67.07 115.49 6.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.083 0.468 . . . . 0.0 111.992 -176.464 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -83.78 -21.99 32.0 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 -177.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -70.42 -22.45 62.72 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 120.527 -0.469 . . . . 0.0 112.119 -177.143 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -152.24 126.68 9.36 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.588 175.552 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.8 tptt -64.37 -47.8 77.9 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.555 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -57.75 -39.78 78.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.339 0.59 . . . . 0.0 111.347 -174.689 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 59.8 t -55.99 -45.15 80.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.121 176.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.2 ttp -65.87 -44.08 86.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.28 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.04 -46.69 80.2 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -69.43 -38.95 78.07 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.682 -0.807 . . . . 0.0 110.871 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.64 85.99 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.211 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.37 -50.98 65.56 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.439 -1.255 . . . . 0.0 113.361 179.516 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -42.13 89.53 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.55 -49.66 50.83 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.935 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.177 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -55.12 -44.82 75.37 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.5 m -66.4 -36.94 84.11 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 122.829 0.451 . . . . 0.0 110.997 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 5.7 mtt85 -58.32 -31.78 67.86 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.023 -0.423 . . . . 0.0 110.118 175.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.926 HD22 HG21 ' A' ' 508' ' ' VAL . 4.6 mt -76.64 -31.75 57.57 Favored 'General case' 0 CA--C 1.5 -0.958 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -176.392 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -38.86 92.59 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.153 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.2 m . . . . . 0 C--N 1.32 -0.699 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 178.137 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 C--O 1.225 -0.187 0 CA-C-O 121.098 0.475 . . . . 0.0 111.645 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 41.1 t -55.87 -47.57 79.54 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.858 0 O-C-N 122.109 -0.37 . . . . 0.0 111.656 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.412 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.3 pt-20 -63.53 -33.95 76.71 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -67.73 -42.32 82.1 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -69.66 -33.25 72.32 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.63 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.16 -38.95 71.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.741 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -53.86 -39.53 65.73 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.855 -178.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -70.9 -55.43 8.46 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.34 -47.72 78.23 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.484 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -60.95 -40.31 92.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 64.6 m -64.85 -42.0 95.25 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.921 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -62.99 -41.79 99.66 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.03 178.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -54.41 -48.45 68.87 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.021 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.274 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -65.9 -40.51 91.6 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -176.332 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -68.88 -26.59 65.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.655 0.264 . . . . 0.0 111.004 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -72.5 -17.68 61.73 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 178.431 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 486' ' ' LEU . . . . . 0.421 HD11 ' CG2' ' A' ' 526' ' ' ILE . 25.0 mt -103.93 12.14 34.66 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -55.27 128.01 32.01 Favored 'General case' 0 C--O 1.21 -1.019 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 178.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 52.5 t -63.0 -40.46 89.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 122.117 0.96 . . . . 0.0 109.46 179.323 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -65.87 -31.64 72.69 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 113.981 -1.463 . . . . 0.0 112.691 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 17.2 t -159.8 78.19 2.76 Favored Pre-proline 0 C--O 1.246 0.877 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.799 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.29 148.73 44.18 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 115.832 -2.312 . . . . 0.0 112.153 178.299 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -137.32 97.72 3.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.61 0.719 . . . . 0.0 109.093 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.436 HG22 ' HB3' ' A' ' 532' ' ' ASN . 70.8 t -59.13 -42.85 87.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.676 -178.427 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -60.46 -35.64 76.35 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.492 0.587 . . . . 0.0 110.871 -177.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 40.7 ttm180 -65.1 -43.07 93.25 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.097 0.475 . . . . 0.0 109.933 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.467 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.3 OUTLIER -65.27 -50.39 65.94 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 177.584 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 86.7 mt -56.9 -42.29 79.63 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 111.357 0.132 . . . . 0.0 111.357 -176.101 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -65.62 -38.57 89.81 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.35 0.595 . . . . 0.0 111.67 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -66.57 -47.18 73.6 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 177.798 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.467 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -57.35 -42.71 82.55 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.605 177.685 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -64.77 -37.15 86.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 119.073 0.851 . . . . 0.0 112.541 -177.474 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -69.83 -45.01 68.76 Favored 'General case' 0 C--O 1.225 -0.219 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 177.775 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.76 -35.31 68.49 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.291 0.567 . . . . 0.0 110.927 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.94 -19.27 67.53 Favored Glycine 0 C--O 1.24 0.506 0 N-CA-C 114.928 0.731 . . . . 0.0 114.928 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.3 t -109.06 -16.28 14.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 117.582 0.691 . . . . 0.0 110.091 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.7 mt -65.03 144.16 57.47 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.348 0.594 . . . . 0.0 109.935 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.503 ' O ' HD13 ' A' ' 512' ' ' ILE . 47.4 mt-30 -78.12 84.52 4.35 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 122.01 0.91 . . . . 0.0 109.747 177.225 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.833 HG21 HD22 ' A' ' 546' ' ' LEU . 35.5 m -98.92 45.0 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-O 123.008 1.385 . . . . 0.0 108.03 179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.45 173.69 3.16 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.148 -1.387 . . . . 0.0 107.691 -177.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.28 -32.44 10.88 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 -173.556 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.49 -45.11 77.04 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.503 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.66 -39.23 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 0 CA-C-O 121.2 0.524 . . . . 0.0 109.718 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -35.82 75.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -175.125 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -64.74 -32.81 74.66 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.567 0.698 . . . . 0.0 111.71 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -95.05 1.16 55.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.592 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -132.2 42.97 3.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.845 0.831 . . . . 0.0 111.917 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.0 p -65.22 -28.65 69.51 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 121.673 -0.642 . . . . 0.0 111.905 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -67.38 -26.21 66.35 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.547 0.689 . . . . 0.0 111.991 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 65.5 t -70.24 -43.86 78.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 178.381 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 44.0 t -62.49 -35.3 69.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 178.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.43 -39.88 94.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 119.018 -0.515 . . . . 0.0 111.203 177.102 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 99.3 m -73.57 -39.15 64.87 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 119.33 0.968 . . . . 0.0 109.911 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.672 HD23 HD11 ' A' ' 526' ' ' ILE . 62.7 mt -57.87 -35.31 70.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.791 0.329 . . . . 0.0 111.09 178.677 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -65.35 -29.04 69.73 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.751 -0.593 . . . . 0.0 111.548 175.702 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -73.15 -44.63 59.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.021 0.438 . . . . 0.0 110.631 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.672 HD11 HD23 ' A' ' 523' ' ' LEU . 14.7 pt -78.26 -24.48 13.76 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.847 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -175.654 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.499 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -59.26 -19.37 45.4 Favored 'General case' 0 C--O 1.213 -0.833 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 176.039 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -118.67 19.12 13.31 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 122.911 0.484 . . . . 0.0 111.784 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.401 ' HB2' ' HA ' ' A' ' 526' ' ' ILE . 7.9 t80 -73.19 104.62 4.31 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.232 0.539 . . . . 0.0 111.624 -176.389 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -68.32 -32.33 72.37 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 116.419 2.007 . . . . 0.0 116.419 -175.455 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.68 -44.33 94.05 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 122.195 0.998 . . . . 0.0 112.007 -176.551 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 532' ' ' ASN . . . . . 0.436 ' HB3' HG22 ' A' ' 493' ' ' VAL . 67.1 m-20 -113.99 90.34 3.32 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 -174.187 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -53.22 -50.0 65.63 Favored 'General case' 0 C--O 1.207 -1.163 0 O-C-N 122.33 -0.231 . . . . 0.0 110.958 -179.143 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -58.9 -37.74 77.3 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.845 0.355 . . . . 0.0 111.625 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 535' ' ' VAL . . . . . 0.416 HG23 HG13 ' A' ' 493' ' ' VAL . 42.7 t -57.62 -44.41 85.3 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.559 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.322 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -63.93 -44.94 91.38 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.53 -47.67 80.69 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -70.44 -40.24 73.89 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 119.552 -0.859 . . . . 0.0 110.648 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.89 -40.02 87.32 Favored 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.175 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.499 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -61.01 -49.41 77.51 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 178.062 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -44.31 95.66 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.44 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.54 -51.45 51.54 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.774 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.059 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -53.93 -46.2 71.46 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 122.787 0.435 . . . . 0.0 110.27 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 33.2 m -63.29 -38.96 93.21 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 122.966 0.506 . . . . 0.0 110.982 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -62.21 -29.75 70.6 Favored 'General case' 0 C--O 1.215 -0.734 0 O-C-N 121.69 -0.631 . . . . 0.0 110.803 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.833 HD22 HG21 ' A' ' 508' ' ' VAL . 5.2 mt -75.12 -30.73 60.92 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 -178.37 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -34.37 77.94 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.712 177.252 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 C--N 1.32 -0.674 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 177.357 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.9 m . . . . . 0 C--O 1.225 -0.231 0 CA-C-O 121.125 0.488 . . . . 0.0 112.189 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.445 HG13 ' HB3' ' A' ' 506' ' ' LEU . 38.0 t -54.17 -48.99 65.31 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.878 0 O-C-N 122.027 -0.421 . . . . 0.0 111.997 179.358 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.41 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.2 pt-20 -61.26 -34.2 74.78 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -178.891 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -67.47 -41.77 84.07 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -72.51 -35.47 68.12 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.942 -177.665 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.553 HD21 HG21 ' A' ' 519' ' ' VAL . 3.8 tt -58.29 -37.83 75.82 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.578 178.623 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -57.73 -41.87 82.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 118.593 0.633 . . . . 0.0 110.293 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -67.53 -53.17 30.79 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 120.378 -0.529 . . . . 0.0 110.089 178.478 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -44.7 86.47 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.658 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.434 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.9 t-160 -58.31 -43.85 88.35 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -179.034 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.9 m -63.77 -37.66 88.19 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -65.78 -37.66 86.91 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.193 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -58.08 -45.51 88.35 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.115 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 24.4 mmtt -61.11 -45.63 93.9 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -64.17 -34.51 78.23 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.715 0.293 . . . . 0.0 110.639 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.73 -16.54 64.18 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.488 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.9 mt -109.99 12.11 23.8 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -56.78 130.62 46.39 Favored 'General case' 0 C--O 1.21 -1.024 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 46.2 t -62.5 -40.93 89.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 122.303 1.049 . . . . 0.0 108.863 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -67.19 -30.19 70.07 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.638 -1.619 . . . . 0.0 113.093 -178.799 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.6 t -160.93 76.4 2.53 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -175.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -75.54 146.46 30.81 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 116.896 -1.603 . . . . 0.0 113.053 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -137.21 99.96 4.13 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.447 0.641 . . . . 0.0 110.354 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.3 -46.17 81.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.781 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -58.43 -32.68 68.92 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 121.935 0.874 . . . . 0.0 109.773 -176.558 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -70.76 -39.87 73.01 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.325 -1.307 . . . . 0.0 108.835 -175.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.409 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -66.01 -50.14 65.29 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 175.243 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 79.2 mt -56.62 -43.09 79.88 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -175.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.74 -38.38 90.81 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.619 0.723 . . . . 0.0 111.868 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -71.24 -45.24 63.69 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 121.655 -0.653 . . . . 0.0 109.617 178.45 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.409 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -55.04 -48.14 73.82 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.804 177.243 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -62.33 -35.64 79.71 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -175.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -67.41 -49.4 63.96 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.96 -33.51 62.42 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.393 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.95 -18.52 70.78 Favored Glycine 0 C--O 1.24 0.471 0 N-CA-C 115.176 0.831 . . . . 0.0 115.176 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.5 t -109.95 -13.36 14.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 118.085 0.942 . . . . 0.0 110.225 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.445 ' HB3' HG13 ' A' ' 471' ' ' VAL . 5.2 mt -67.02 146.85 53.92 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 122.021 -0.424 . . . . 0.0 110.949 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.469 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.4 tt0 -78.65 84.43 4.75 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-O 122.544 1.164 . . . . 0.0 109.103 177.213 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.913 HG21 HD22 ' A' ' 546' ' ' LEU . 27.0 m -98.82 47.39 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-O 122.968 1.366 . . . . 0.0 108.708 -178.258 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.8 t -66.78 172.34 4.42 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 106.824 -1.546 . . . . 0.0 106.824 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.0 m -49.17 -32.87 11.06 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -173.705 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -55.39 -44.81 76.49 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.469 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -85.75 -41.83 15.63 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.448 0 CA-C-O 121.774 0.797 . . . . 0.0 109.231 179.029 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.484 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.69 -37.51 79.04 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -175.387 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -65.39 -31.98 73.38 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.604 0.716 . . . . 0.0 112.203 -178.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -93.72 -6.12 46.89 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.085 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -127.93 39.97 3.76 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.533 0.682 . . . . 0.0 111.819 -178.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 28.2 p -63.8 -24.83 67.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -61.83 -32.54 72.87 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.475 0.655 . . . . 0.0 112.313 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.553 HG21 HD21 ' A' ' 475' ' ' LEU . 21.3 t -71.32 -40.99 74.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 31.7 t -62.86 -38.36 81.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.655 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.42 -30.2 71.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.948 177.845 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.6 m -82.58 -39.26 22.51 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.48 HD23 HD11 ' A' ' 526' ' ' ILE . 31.9 mt -57.56 -36.53 71.79 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.285 0.564 . . . . 0.0 110.881 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -62.44 -28.55 69.88 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 122.165 -0.335 . . . . 0.0 111.536 175.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -76.96 -42.18 40.12 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 178.227 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.48 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -78.76 -22.23 12.95 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.106 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -177.303 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.432 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -60.52 -18.12 50.02 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 122.431 0.292 . . . . 0.0 111.547 175.674 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -118.67 19.38 13.22 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.198 0.599 . . . . 0.0 111.571 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -66.64 110.35 3.18 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.195 0.521 . . . . 0.0 112.187 -176.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -74.39 -28.05 60.92 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.15 -41.67 94.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -175.468 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -131.94 111.05 11.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 -178.244 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -55.58 -44.24 76.73 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.045 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -55.9 -42.74 76.45 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.004 0.431 . . . . 0.0 112.058 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -57.56 -44.38 84.97 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -62.83 -44.49 96.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.063 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.25 -46.89 78.74 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.3 tptt -69.04 -39.66 79.07 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 119.1 -1.04 . . . . 0.0 111.071 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.72 -40.26 87.4 Favored 'General case' 0 C--O 1.212 -0.87 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.426 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.432 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.42 -50.44 71.49 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.287 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -45.5 89.72 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 60.6 t -67.11 -49.57 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.979 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.202 -177.084 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -56.01 -44.98 79.21 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 26.6 m -66.12 -35.63 81.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.295 0.569 . . . . 0.0 111.161 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 54.2 mtt-85 -61.27 -27.81 68.74 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 121.705 -0.622 . . . . 0.0 110.469 175.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.913 HD22 HG21 ' A' ' 508' ' ' VAL . 9.9 mt -76.48 -35.78 58.22 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -176.516 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -28.01 69.71 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 114.735 -1.121 . . . . 0.0 111.432 178.32 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 C--N 1.314 -0.961 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.662 178.137 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.8 m . . . . . 0 C--O 1.223 -0.325 0 CA-C-O 120.819 0.342 . . . . 0.0 111.557 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 39.3 t -53.76 -48.41 61.25 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.05 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -63.16 -34.21 77.13 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -178.34 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.69 -39.92 88.32 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 179.242 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -74.16 -35.79 64.05 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.214 -178.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.555 HD21 HG21 ' A' ' 519' ' ' VAL . 5.2 tt -58.63 -38.68 78.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.047 -0.978 . . . . 0.0 109.332 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -55.21 -40.32 70.66 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -71.8 -53.61 12.81 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.27 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -45.84 79.47 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -178.32 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.45 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.9 t-160 -59.13 -41.94 89.44 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -179.585 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.5 m -65.21 -40.02 93.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 119.441 -0.314 . . . . 0.0 111.196 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.5 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 50.5 mm-40 -65.02 -40.51 94.98 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.368 178.751 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.9 mt -54.29 -48.5 67.35 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.06 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -65.89 -38.36 88.55 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -177.363 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -66.84 -32.35 73.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.664 0.269 . . . . 0.0 110.299 177.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -20.42 66.0 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.9 mt -101.15 12.05 38.32 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 12.6 mtpp -56.72 122.22 11.62 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 40.1 t -60.98 -39.04 80.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 122.481 1.134 . . . . 0.0 109.4 178.727 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -64.26 -28.21 69.57 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 113.525 -1.67 . . . . 0.0 112.811 -178.493 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -168.73 81.13 0.74 Allowed Pre-proline 0 N--CA 1.47 0.538 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.13 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.87 149.44 33.28 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 118.083 -0.811 . . . . 0.0 113.182 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -137.28 99.23 3.92 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.526 0.679 . . . . 0.0 110.871 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.96 -45.36 87.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -179.192 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -58.79 -32.13 69.05 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -69.49 -40.28 77.12 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.867 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.431 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.99 -49.92 66.1 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 176.053 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.64 -43.97 80.83 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -176.002 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -63.5 -37.45 87.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.565 0.698 . . . . 0.0 111.447 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.5 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -70.48 -47.49 60.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.365 0.603 . . . . 0.0 109.601 178.076 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.431 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.65 -49.01 71.61 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.227 178.021 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -61.73 -35.37 77.87 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -175.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -47.86 57.89 Favored 'General case' 0 C--O 1.224 -0.266 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 176.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.7 -34.02 67.04 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.401 0.62 . . . . 0.0 110.197 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.94 -17.89 68.09 Favored Glycine 0 C--O 1.236 0.259 0 N-CA-C 115.292 0.877 . . . . 0.0 115.292 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.9 t -110.86 -11.31 14.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 118.003 0.901 . . . . 0.0 110.235 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.7 mt -68.85 148.87 49.62 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 121.939 -0.475 . . . . 0.0 110.296 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.445 ' O ' HD13 ' A' ' 512' ' ' ILE . 26.5 tt0 -77.28 84.48 3.72 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 122.719 1.247 . . . . 0.0 109.087 177.507 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.901 HG21 HD22 ' A' ' 546' ' ' LEU . 31.1 m -100.28 50.18 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 CA-C-O 122.969 1.366 . . . . 0.0 108.167 -178.188 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.1 t -66.53 171.87 4.64 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.398 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 40.4 m -49.32 -31.49 9.27 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -175.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -55.43 -45.08 76.8 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.445 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.1 mp -86.05 -42.88 16.19 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -37.98 81.82 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -175.307 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -69.23 -30.29 68.41 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.219 -178.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -89.16 -5.24 57.88 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 122.187 -0.321 . . . . 0.0 110.901 177.986 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -129.87 43.95 3.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.591 0.71 . . . . 0.0 112.426 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.8 p -63.66 -25.27 68.14 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.08 -31.61 72.91 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.001 0.905 . . . . 0.0 111.922 178.539 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.555 HG21 HD21 ' A' ' 475' ' ' LEU . 57.8 t -69.53 -42.84 80.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 26.5 t -62.72 -38.07 80.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.93 -39.05 93.41 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.334 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 92.6 m -73.68 -38.08 65.03 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 118.483 0.583 . . . . 0.0 110.464 -178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.66 HD23 HD11 ' A' ' 526' ' ' ILE . 63.1 mt -58.7 -35.75 73.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.136 0.493 . . . . 0.0 110.593 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -65.77 -29.14 69.6 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.878 -0.514 . . . . 0.0 111.357 175.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -72.22 -45.51 59.97 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.915 0.388 . . . . 0.0 110.808 178.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.66 HD11 HD23 ' A' ' 523' ' ' LEU . 16.6 pt -78.75 -20.61 12.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.806 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 -176.592 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.428 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.4 OUTLIER -62.45 -17.56 59.69 Favored 'General case' 0 C--O 1.213 -0.864 0 O-C-N 121.783 -0.573 . . . . 0.0 111.897 176.022 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.7 19.35 13.21 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.217 0.607 . . . . 0.0 111.411 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -65.5 114.65 5.03 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.024 0.44 . . . . 0.0 111.943 -177.334 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -75.2 -29.92 60.48 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.45 -40.72 96.26 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -132.57 112.1 11.79 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.23 -178.176 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 40.2 tptt -56.67 -43.69 80.64 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.388 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -55.74 -43.27 76.46 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.189 0.441 . . . . 0.0 112.189 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 67.4 t -57.35 -44.51 84.35 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -63.85 -43.53 95.85 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.99 -47.94 75.74 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.858 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -69.28 -38.98 78.6 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 118.864 -1.134 . . . . 0.0 110.586 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 539' ' ' ALA . . . . . 0.402 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -59.37 -41.26 88.88 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-O 121.442 0.639 . . . . 0.0 109.498 178.827 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.428 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.91 -48.25 77.34 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.913 -1.04 . . . . 0.0 112.924 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -41.51 92.58 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 52.8 t -70.6 -51.25 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.286 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -54.63 -45.9 73.83 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 122.499 0.32 . . . . 0.0 110.278 -177.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 16.0 m -65.78 -34.61 78.56 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.289 0.566 . . . . 0.0 111.197 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.01 -28.76 70.32 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 121.803 -0.561 . . . . 0.0 109.966 175.396 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.901 HD22 HG21 ' A' ' 508' ' ' VAL . 9.1 mt -76.57 -33.33 58.49 Favored 'General case' 0 C--O 1.207 -1.143 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 -176.53 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -27.28 69.15 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.208 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 C--N 1.315 -0.915 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.866 177.751 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.7 m . . . . . 0 C--O 1.224 -0.269 0 CA-C-O 120.733 0.301 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 51.7 t -55.86 -46.77 80.21 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 CA-C-O 120.879 0.371 . . . . 0.0 111.626 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.9 OUTLIER -65.92 -34.1 77.36 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.894 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -67.92 -40.86 83.33 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 176.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -69.14 -34.66 75.37 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.035 -178.936 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -56.09 -39.9 72.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.398 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -53.4 -39.7 64.51 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.995 -178.721 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -70.69 -56.49 6.29 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.619 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -45.8 86.04 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -176.118 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -59.49 -42.65 92.61 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 58.5 m -63.59 -38.45 91.17 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.075 0.234 . . . . 0.0 111.306 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.407 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 10.8 mm-40 -64.25 -38.25 90.39 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.649 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 92.5 mt -59.93 -41.73 87.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.088 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 51.6 mmtt -64.5 -45.22 88.2 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 121.832 -0.543 . . . . 0.0 112.068 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -65.77 -32.17 73.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.712 0.292 . . . . 0.0 110.794 -178.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.63 -16.97 64.58 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 178.627 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 34.5 mt -111.21 12.3 21.8 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -177.214 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -54.19 133.33 44.38 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 177.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 63.5 t -63.81 -42.32 95.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 122.264 1.031 . . . . 0.0 108.393 176.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -68.29 -28.32 67.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.735 -1.575 . . . . 0.0 113.597 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 20.3 m -157.59 73.53 4.25 Favored Pre-proline 0 N--CA 1.472 0.645 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -72.25 143.37 39.38 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 115.194 -2.737 . . . . 0.0 112.204 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -137.28 100.65 4.31 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.689 0.756 . . . . 0.0 110.563 -178.714 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -47.28 91.58 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.867 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.943 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -57.59 -31.85 66.59 Favored 'General case' 0 CA--C 1.506 -0.716 0 O-C-N 123.301 0.376 . . . . 0.0 110.04 -177.526 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -70.88 -39.4 72.87 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -177.331 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.1 -48.96 69.2 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.434 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.86 -42.38 79.65 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.489 0.185 . . . . 0.0 111.314 -175.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -67.01 -36.8 82.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.44 0.638 . . . . 0.0 112.125 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.407 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.78 -45.86 67.05 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.411 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.45 -44.1 80.14 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.746 -1.116 . . . . 0.0 111.086 178.008 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -63.41 -37.39 87.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 119.156 0.889 . . . . 0.0 112.616 -177.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -70.51 -44.84 66.76 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 177.608 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.31 -35.79 67.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.237 0.541 . . . . 0.0 111.323 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.62 -20.35 69.95 Favored Glycine 0 C--O 1.24 0.506 0 N-CA-C 114.779 0.671 . . . . 0.0 114.779 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.2 t -107.14 -16.01 14.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 117.338 0.569 . . . . 0.0 110.081 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -65.47 145.53 56.01 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.095 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.474 ' O ' HD13 ' A' ' 512' ' ' ILE . 28.2 tt0 -80.09 79.59 6.62 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-O 122.542 1.163 . . . . 0.0 109.167 178.21 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.827 HG21 HD22 ' A' ' 546' ' ' LEU . 29.6 m -94.07 47.18 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 CA-C-O 122.991 1.377 . . . . 0.0 107.628 179.426 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.21 173.69 3.02 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 -178.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 13.8 m -48.32 -34.98 11.44 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 -173.425 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -54.86 -44.19 73.79 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 177.728 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.474 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -87.68 -38.74 12.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.418 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.84 -36.75 79.91 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -175.885 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -65.88 -32.29 73.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.385 0.612 . . . . 0.0 111.983 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -93.24 -1.64 55.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.493 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -129.46 44.94 2.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.815 0.817 . . . . 0.0 112.099 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 23.7 p -65.51 -28.18 69.01 Favored 'General case' 0 C--N 1.32 -0.678 0 O-C-N 121.746 -0.596 . . . . 0.0 112.132 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -66.74 -27.21 67.43 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.663 0.744 . . . . 0.0 111.838 177.396 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.7 t -70.72 -43.6 77.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.8 t -63.53 -37.17 78.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.32 -33.71 76.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.918 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 80.1 m -78.69 -40.27 34.34 Favored 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.547 HD23 HD11 ' A' ' 526' ' ' ILE . 40.2 mt -57.61 -35.4 70.4 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.124 0.488 . . . . 0.0 110.933 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.04 -26.92 68.78 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.895 -0.503 . . . . 0.0 111.886 175.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -76.47 -43.38 40.1 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.547 HD11 HD23 ' A' ' 523' ' ' LEU . 1.2 pt -78.81 -22.08 12.9 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.988 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -177.33 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.468 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -64.49 -12.1 40.63 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 175.317 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -121.14 19.32 11.56 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.821 0.448 . . . . 0.0 110.474 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.7 112.78 3.0 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.494 0.664 . . . . 0.0 112.497 -174.419 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -78.37 -31.42 48.48 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.55 -26.96 65.68 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -175.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.6 122.35 10.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.164 0.507 . . . . 0.0 112.354 176.933 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -64.15 -40.4 96.07 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -61.85 -40.86 96.82 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.552 0.692 . . . . 0.0 109.986 -176.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.3 t -58.03 -43.21 84.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.089 176.996 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 32.5 ttm -59.73 -48.64 80.85 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-O 120.8 0.333 . . . . 0.0 110.852 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -68.14 -45.72 72.82 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -178.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 44.7 tptt -69.51 -38.5 77.61 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 118.931 -1.107 . . . . 0.0 110.482 -177.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -60.13 -38.93 84.54 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.922 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.468 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.62 -48.91 70.65 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.716 -1.129 . . . . 0.0 113.981 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -40.5 87.79 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 61.9 t -70.59 -53.02 24.16 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.867 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.563 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -53.8 -45.1 70.63 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 122.372 0.269 . . . . 0.0 111.22 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 25.3 m -65.05 -36.98 86.08 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.171 0.588 . . . . 0.0 111.157 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 37.2 mtt85 -62.08 -29.96 70.67 Favored 'General case' 0 C--O 1.216 -0.674 0 O-C-N 121.563 -0.711 . . . . 0.0 110.59 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.827 HD22 HG21 ' A' ' 508' ' ' VAL . 4.7 mt -76.38 -31.12 57.82 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -175.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -42.49 99.17 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 175.722 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 18.0 m . . . . . 0 C--N 1.319 -0.75 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 178.553 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.223 -0.303 0 CA-C-O 120.959 0.409 . . . . 0.0 111.798 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 41.1 t -53.63 -46.09 60.67 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.947 0 O-C-N 122.016 -0.427 . . . . 0.0 112.103 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.03 -34.14 77.73 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.85 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -67.54 -40.2 85.03 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -73.07 -32.72 65.21 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.228 -177.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.419 HD23 HD21 ' A' ' 503' ' ' LEU . 1.9 tm? -57.43 -39.34 76.02 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.062 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -53.2 -39.83 63.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.87 0.304 . . . . 0.0 110.268 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -71.72 -57.28 4.51 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.866 177.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.79 -45.88 78.12 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -176.858 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -59.31 -42.01 90.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.9 m -65.14 -37.78 88.51 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 123.13 0.268 . . . . 0.0 111.476 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.49 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 46.5 mm-40 -64.74 -37.05 86.3 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.961 -0.695 . . . . 0.0 110.279 178.745 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -59.1 -42.58 86.99 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.063 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -62.51 -46.87 86.46 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -65.35 -33.13 75.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.89 0.376 . . . . 0.0 111.224 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.01 -17.32 64.61 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.6 mt -110.48 12.0 22.99 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -176.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -55.3 130.06 40.89 Favored 'General case' 0 C--O 1.208 -1.094 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 177.557 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 51.0 t -63.01 -40.49 89.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 122.267 1.032 . . . . 0.0 108.88 178.089 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.17 -29.87 69.68 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.756 -1.565 . . . . 0.0 113.011 -178.763 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 18.1 t -161.45 78.97 2.16 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.56 146.17 34.27 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 118.11 -0.794 . . . . 0.0 112.767 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -137.28 101.17 4.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.679 0.752 . . . . 0.0 110.804 -179.534 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.407 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.7 OUTLIER -60.05 -45.26 95.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -179.149 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -61.76 -31.08 71.25 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -69.19 -41.3 77.33 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -178.075 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.433 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -65.0 -48.29 74.48 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.004 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 73.7 mt -56.69 -44.96 82.01 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.885 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -62.18 -41.0 97.93 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.799 0.809 . . . . 0.0 110.053 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.49 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.11 -48.16 68.97 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.339 0.59 . . . . 0.0 109.847 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.433 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.5 -45.76 84.54 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.379 178.944 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -63.25 -35.37 80.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 119.006 0.821 . . . . 0.0 112.475 -176.366 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -71.82 -43.8 64.98 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 177.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.419 HD21 HD23 ' A' ' 475' ' ' LEU . 0.2 OUTLIER -56.18 -33.86 65.67 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.511 0.672 . . . . 0.0 110.657 177.736 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.1 -16.42 66.6 Favored Glycine 0 C--O 1.239 0.411 0 CA-C-O 119.204 -0.775 . . . . 0.0 114.526 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.8 t -113.9 -14.3 12.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 118.042 0.921 . . . . 0.0 110.889 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.5 mt -66.48 145.97 55.06 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.877 -0.514 . . . . 0.0 109.829 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.416 ' O ' HD13 ' A' ' 512' ' ' ILE . 30.0 tt0 -79.11 84.42 5.09 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 122.836 1.303 . . . . 0.0 109.566 178.005 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.975 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -96.59 48.76 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-O 123.18 1.467 . . . . 0.0 107.996 -178.958 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.5 t -66.84 172.23 4.57 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 -178.17 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 2.7 m -49.26 -34.88 16.19 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -173.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -54.72 -44.63 73.67 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 177.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -86.12 -41.66 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.43 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.63 -38.86 82.51 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -175.32 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -69.33 -31.94 70.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.824 -177.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -88.42 -3.96 58.73 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.232 177.664 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -127.52 45.34 2.75 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.858 0.837 . . . . 0.0 112.465 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 17.5 p -64.91 -28.71 69.72 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 121.699 -0.626 . . . . 0.0 112.568 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -69.7 -22.5 63.41 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.503 0.668 . . . . 0.0 112.09 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 87.9 t -71.55 -45.17 69.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 177.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 50.6 t -62.94 -36.79 77.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.553 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.57 79.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.407 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.1 m -77.63 -39.08 46.42 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 118.47 0.577 . . . . 0.0 109.698 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.687 HD23 HD11 ' A' ' 526' ' ' ILE . 48.8 mt -59.11 -31.89 69.34 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.064 0.459 . . . . 0.0 111.464 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -64.73 -29.11 70.08 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.757 -0.589 . . . . 0.0 111.199 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -74.58 -42.59 58.46 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.687 HD11 HD23 ' A' ' 523' ' ' LEU . 1.3 pt -78.8 -22.42 12.92 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.905 0 N-CA-C 114.919 1.452 . . . . 0.0 114.919 -176.518 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.436 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -60.92 -18.8 58.83 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-O 120.845 0.355 . . . . 0.0 111.649 176.151 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -118.85 19.51 13.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.18 0.592 . . . . 0.0 111.508 178.648 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.403 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 14.0 t80 -66.8 118.48 10.38 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 122.661 0.384 . . . . 0.0 111.168 -178.509 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 44.1 mttp -83.13 -26.24 31.16 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 116.003 1.853 . . . . 0.0 116.003 -176.943 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.403 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -64.03 -40.57 96.62 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.614 -0.435 . . . . 0.0 111.564 -175.588 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -133.02 116.2 16.09 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.189 -178.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.9 tptt -57.48 -43.44 84.09 Favored 'General case' 0 C--O 1.21 -1.003 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -52.3 -45.91 65.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.077 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.8 t -58.52 -44.08 88.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.2 ttp -64.17 -44.31 92.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.32 -48.43 78.05 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.849 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.0 tptt -71.67 -38.62 70.63 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 118.315 -1.354 . . . . 0.0 111.961 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.04 -40.04 79.9 Favored 'General case' 0 C--O 1.212 -0.899 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.64 -51.07 68.7 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.09 178.325 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.59 -43.6 89.56 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 60.3 t -67.86 -51.27 51.8 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.809 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.233 -177.345 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -54.67 -44.87 73.7 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.653 0.263 . . . . 0.0 110.41 -177.488 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 40.5 m -63.81 -38.6 91.72 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 123.641 0.776 . . . . 0.0 111.315 179.168 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 66.2 mtt180 -61.69 -28.58 69.5 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 121.62 -0.675 . . . . 0.0 111.061 176.285 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.975 HD22 HG21 ' A' ' 508' ' ' VAL . 5.8 mt -76.52 -31.83 57.89 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 -176.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.25 -38.58 87.21 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.239 177.194 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 C--N 1.321 -0.663 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 178.275 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 C--O 1.224 -0.251 0 CA-C-O 120.975 0.417 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.454 HG13 ' HB3' ' A' ' 506' ' ' LEU . 44.4 t -54.84 -46.92 75.43 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.049 0 O-C-N 122.047 -0.408 . . . . 0.0 111.539 179.502 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.439 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.5 pt-20 -61.03 -34.21 74.5 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -68.19 -41.42 81.44 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.15 0.976 . . . . 0.0 108.453 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -73.32 -34.89 65.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.927 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.563 HD21 HG21 ' A' ' 519' ' ' VAL . 2.6 tt -57.57 -37.99 74.09 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.663 178.355 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.36 -38.65 80.97 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.286 -0.565 . . . . 0.0 110.205 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -68.44 -53.34 24.24 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 176.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.27 -45.77 87.25 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.423 ' CG ' HG22 ' A' ' 519' ' ' VAL . 17.6 t-160 -58.8 -42.84 90.05 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 65.7 m -63.59 -41.71 98.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 119.573 -0.251 . . . . 0.0 111.195 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.442 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 60.9 mm-40 -63.79 -40.84 97.63 Favored 'General case' 0 CA--C 1.501 -0.92 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.28 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.54 -45.8 71.29 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.039 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -68.08 -39.13 82.99 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -67.75 -31.38 71.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.998 0.428 . . . . 0.0 110.408 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.06 -18.61 64.72 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 122.633 0.373 . . . . 0.0 111.807 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 27.0 mt -107.39 12.16 28.27 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -54.91 129.77 38.79 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.0 t -61.25 -40.08 84.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 122.474 1.13 . . . . 0.0 108.852 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -66.33 -28.76 68.92 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 113.398 -1.728 . . . . 0.0 112.676 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 22.9 t -159.59 76.99 2.95 Favored Pre-proline 0 C--O 1.24 0.577 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -73.43 141.61 31.91 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 114.979 -2.881 . . . . 0.0 112.29 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -137.27 105.1 5.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.491 0.662 . . . . 0.0 110.444 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.81 -44.18 96.99 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -58.71 -32.69 69.41 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -178.388 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 22.7 ttp180 -68.51 -41.0 80.59 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.429 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -68.0 -48.98 64.27 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.624 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.89 -44.07 81.95 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -61.91 -38.22 87.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.654 0.74 . . . . 0.0 111.704 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.442 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -70.93 -47.46 58.93 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.499 0.666 . . . . 0.0 109.704 178.382 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.429 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.93 -47.89 73.83 Favored 'General case' 0 N--CA 1.428 -1.537 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.115 178.743 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -61.4 -35.74 78.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.434 0.902 . . . . 0.0 113.434 -175.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.65 -46.13 59.93 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.49 -33.87 68.48 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.337 0.589 . . . . 0.0 109.872 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.64 -16.65 68.05 Favored Glycine 0 C--O 1.239 0.429 0 N-CA-C 115.034 0.774 . . . . 0.0 115.034 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.4 t -112.76 -7.93 13.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 118.136 0.968 . . . . 0.0 111.017 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.454 ' HB3' HG13 ' A' ' 471' ' ' VAL . 3.7 mt -71.89 148.93 45.62 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.424 ' O ' HD13 ' A' ' 512' ' ' ILE . 26.1 tt0 -79.4 84.33 5.32 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 122.757 1.265 . . . . 0.0 109.452 178.027 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.889 HG21 HD22 ' A' ' 546' ' ' LEU . 30.2 m -98.3 48.3 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 CA-C-O 123.028 1.394 . . . . 0.0 107.93 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.0 t -66.24 172.44 3.89 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 -178.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 20.2 m -49.32 -33.25 12.84 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -174.166 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -55.48 -44.35 76.4 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 178.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.424 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -86.63 -41.4 14.89 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 CA-C-O 121.502 0.668 . . . . 0.0 109.348 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.455 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.35 -38.47 80.48 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -176.054 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -63.85 -31.37 72.52 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.641 0.734 . . . . 0.0 112.446 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -95.38 -5.87 42.29 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.447 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -127.91 39.25 3.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.465 0.65 . . . . 0.0 111.296 -178.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.8 p -62.56 -25.48 68.08 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -178.912 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.36 -31.78 73.02 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.424 0.631 . . . . 0.0 112.155 178.211 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.563 HG21 HD21 ' A' ' 475' ' ' LEU . 41.3 t -71.15 -40.87 75.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.4 t -62.5 -37.75 79.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 178.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.69 92.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.38 177.191 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.5 m -73.68 -37.99 65.05 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 118.383 0.538 . . . . 0.0 110.536 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.686 HD23 HD11 ' A' ' 526' ' ' ILE . 68.6 mt -59.36 -34.51 72.49 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.929 0.395 . . . . 0.0 110.815 178.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -65.57 -29.04 69.6 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.807 -0.558 . . . . 0.0 111.212 175.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -71.21 -45.88 62.38 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 120.816 0.341 . . . . 0.0 110.986 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.686 HD11 HD23 ' A' ' 523' ' ' LEU . 5.3 pt -78.79 -20.4 12.98 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.987 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -177.391 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.446 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.97 -12.48 38.08 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 121.678 -0.638 . . . . 0.0 112.537 176.919 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -118.83 15.78 13.47 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 122.527 0.331 . . . . 0.0 111.57 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.411 ' CE2' ' HB3' ' A' ' 531' ' ' ALA . 18.2 t80 -63.32 122.85 17.21 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.203 0.525 . . . . 0.0 112.005 -176.749 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -92.38 -26.3 18.11 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 116.484 2.031 . . . . 0.0 116.484 -177.378 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.411 ' HB3' ' CE2' ' A' ' 529' ' ' TYR . . . -62.7 -42.29 99.56 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.719 0.771 . . . . 0.0 110.559 -176.79 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -129.6 111.88 13.15 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.162 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -61.02 -38.05 84.73 Favored 'General case' 0 C--O 1.209 -1.038 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.731 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -57.15 -41.96 80.11 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 55.0 t -56.45 -43.28 77.4 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 6.9 ttp -66.47 -40.11 89.17 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 122.369 0.268 . . . . 0.0 110.759 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.24 -51.38 63.92 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 123.086 0.241 . . . . 0.0 110.368 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -70.16 -38.29 75.42 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 119.401 -0.92 . . . . 0.0 111.239 -177.616 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 539' ' ' ALA . . . . . 0.463 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -58.35 -40.71 82.92 Favored 'General case' 0 C--O 1.213 -0.868 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.465 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.446 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.51 -47.79 74.75 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.896 -1.047 . . . . 0.0 112.854 179.294 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -42.59 92.13 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.1 t -70.59 -49.72 50.2 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.085 0 C-N-CA 122.883 0.473 . . . . 0.0 111.61 -177.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -55.63 -44.97 77.62 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -178.064 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.3 m -66.71 -36.29 82.15 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 122.792 0.437 . . . . 0.0 110.889 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 9.3 mtt85 -58.84 -30.21 67.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.979 -0.451 . . . . 0.0 110.263 175.245 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.889 HD22 HG21 ' A' ' 508' ' ' VAL . 8.7 mt -76.63 -34.79 58.32 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -176.064 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -30.45 70.73 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.674 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 C--N 1.318 -0.796 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.428 177.306 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.2 m . . . . . 0 C--O 1.223 -0.314 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.403 HG13 ' HB3' ' A' ' 506' ' ' LEU . 41.9 t -53.9 -46.75 64.59 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.389 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.429 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.6 pt-20 -62.09 -34.16 75.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.74 0.305 . . . . 0.0 111.566 -177.536 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.47 -41.9 79.49 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -73.17 -34.09 65.83 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.281 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.552 HD21 HG21 ' A' ' 519' ' ' VAL . 3.0 tt -58.95 -35.87 73.87 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.481 178.119 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -59.11 -40.18 84.56 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.906 -0.718 . . . . 0.0 109.647 178.629 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -67.29 -54.16 23.25 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.151 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -45.18 81.53 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.402 ' CG ' HG22 ' A' ' 519' ' ' VAL . 18.8 t-160 -58.89 -41.8 88.03 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 57.4 m -65.3 -39.31 92.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 119.406 -0.331 . . . . 0.0 111.649 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.506 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 58.5 mm-40 -64.49 -41.01 96.71 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.846 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.88 -47.22 75.78 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.214 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 177.219 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -65.79 -38.43 88.98 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -67.3 -34.01 76.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.866 0.365 . . . . 0.0 110.414 177.788 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.6 -17.45 64.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.0 mt -107.28 11.93 28.71 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -177.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -57.2 129.69 42.88 Favored 'General case' 0 CA--C 1.497 -1.081 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 16.1 m -71.32 -19.53 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.079 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.942 -178.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.84 -27.91 30.51 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 113.47 -1.695 . . . . 0.0 110.823 -179.562 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 77.4 p -163.76 79.19 1.57 Allowed Pre-proline 0 C--O 1.241 0.623 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.897 -176.314 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -73.49 147.84 41.68 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 115.493 -2.538 . . . . 0.0 112.782 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -137.28 100.09 4.16 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.751 0.786 . . . . 0.0 109.726 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.425 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.4 OUTLIER -60.5 -47.6 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.838 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -177.666 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -60.69 -30.15 69.75 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 -177.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.2 ttt180 -68.32 -41.59 80.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.448 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.38 -47.74 78.1 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.17 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 86.2 mt -57.37 -44.47 84.45 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -176.445 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -62.22 -38.49 89.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.772 0.796 . . . . 0.0 110.115 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.16 -48.32 62.58 Favored 'General case' 0 C--N 1.321 -0.631 0 O-C-N 121.693 -0.629 . . . . 0.0 110.078 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.448 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -56.18 -48.25 76.72 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.882 178.255 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -62.15 -35.71 79.61 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -175.404 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -72.78 -43.09 63.24 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 119.02 -1.072 . . . . 0.0 108.602 177.256 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.48 -35.82 70.67 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.237 0.541 . . . . 0.0 110.325 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.8 -18.81 68.85 Favored Glycine 0 C--O 1.242 0.602 0 N-CA-C 114.996 0.758 . . . . 0.0 114.996 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.8 t -109.27 -10.31 14.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 117.717 0.758 . . . . 0.0 110.293 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.403 ' HB3' HG13 ' A' ' 471' ' ' VAL . 1.4 mt -71.16 148.89 46.92 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.797 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.452 ' O ' HD13 ' A' ' 512' ' ' ILE . 32.6 tt0 -79.76 84.26 5.59 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 122.261 1.029 . . . . 0.0 109.264 178.476 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.921 HG21 HD22 ' A' ' 546' ' ' LEU . 35.5 m -98.54 47.73 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.163 0 CA-C-O 123.344 1.545 . . . . 0.0 108.188 -178.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 13.3 t -68.16 173.73 4.47 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.5 m -49.37 -33.76 14.41 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -173.09 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -53.91 -43.43 69.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 177.62 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.452 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.63 -41.77 14.31 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 CA-C-O 121.979 0.895 . . . . 0.0 109.431 179.371 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -39.47 81.3 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -175.406 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -67.55 -32.43 73.19 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.649 -178.365 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -89.11 -10.02 48.89 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.935 -0.306 . . . . 0.0 111.202 179.106 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -125.65 40.99 3.62 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.484 0.659 . . . . 0.0 112.163 -176.113 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 23.8 p -63.51 -24.45 67.82 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -62.15 -31.82 72.36 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.022 0.439 . . . . 0.0 112.024 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.552 HG21 HD21 ' A' ' 475' ' ' LEU . 23.6 t -71.11 -40.27 75.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 49.0 t -62.56 -36.83 76.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 178.193 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.82 -37.52 87.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.825 177.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.5 m -75.89 -38.38 57.87 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 118.531 0.605 . . . . 0.0 110.017 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.507 HD23 HD11 ' A' ' 526' ' ' ILE . 46.4 mt -57.78 -34.96 70.16 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.951 0.405 . . . . 0.0 111.417 178.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -65.33 -29.09 69.79 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 121.976 -0.453 . . . . 0.0 111.376 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -73.7 -44.32 56.82 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.733 0.301 . . . . 0.0 111.189 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.507 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.23 -22.14 13.46 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.877 0 N-CA-C 114.323 1.231 . . . . 0.0 114.323 -176.783 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -62.6 -16.03 54.4 Favored 'General case' 0 C--O 1.214 -0.793 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 176.555 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -118.65 19.28 13.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.044 0.538 . . . . 0.0 111.61 177.568 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -69.5 95.11 0.8 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -63.64 -27.59 69.34 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -178.122 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.5 -31.06 72.11 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -176.098 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -144.77 108.24 4.63 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.7 tptt -53.96 -46.27 71.57 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.043 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -55.92 -43.42 77.35 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.038 0.446 . . . . 0.0 111.992 -176.66 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.53 -44.76 85.54 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.491 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.575 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.3 ttp -64.72 -42.85 94.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 119.283 -0.389 . . . . 0.0 110.279 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -64.52 -48.36 75.41 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.828 179.289 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -68.88 -39.16 79.96 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 118.978 -1.089 . . . . 0.0 110.908 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.18 83.84 Favored 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 109.084 -0.709 . . . . 0.0 109.084 177.954 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.99 -48.21 71.99 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.868 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -42.12 93.64 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.9 t -70.52 -51.43 37.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.921 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.578 -178.553 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -54.07 -44.84 71.46 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 -177.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.7 m -66.17 -34.84 78.96 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 123.111 0.564 . . . . 0.0 111.638 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 26.1 mtt85 -62.45 -31.18 71.86 Favored 'General case' 0 C--O 1.217 -0.648 0 O-C-N 121.771 -0.581 . . . . 0.0 109.698 175.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.921 HD22 HG21 ' A' ' 508' ' ' VAL . 5.7 mt -75.03 -34.69 61.91 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -176.376 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -59.79 -33.43 71.71 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.392 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--N 1.322 -0.589 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 179.753 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.1 m . . . . . 0 C--O 1.224 -0.255 0 CA-C-O 121.307 0.575 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.46 HG13 ' HB3' ' A' ' 506' ' ' LEU . 53.3 t -56.08 -47.23 80.74 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.771 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -64.08 -34.24 77.58 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -67.27 -43.64 81.33 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.991 0.901 . . . . 0.0 108.783 177.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 24.8 mttt -69.04 -34.27 74.94 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.0 -178.144 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.412 HD21 HG21 ' A' ' 519' ' ' VAL . 1.5 tm? -58.63 -36.98 74.93 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.355 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -54.92 -40.78 70.23 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.04 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 62.6 tttt -68.97 -55.06 12.06 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 176.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.23 -46.87 79.37 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -176.357 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -60.88 -40.61 93.65 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.0 m -63.98 -41.89 97.39 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.549 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.46 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.5 mm-40 -63.12 -42.89 99.61 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 118.004 0.365 . . . . 0.0 110.872 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.63 -47.49 72.49 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -67.2 -37.32 83.47 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -177.079 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -67.15 -33.73 76.05 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.569 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.0 -17.36 64.89 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 27.9 mt -107.06 12.08 28.94 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -56.05 132.42 50.05 Favored 'General case' 0 C--O 1.21 -1.006 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 177.041 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.84 -41.1 91.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 175.645 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -65.55 -28.76 69.39 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.056 -1.884 . . . . 0.0 113.782 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 19.0 m -159.93 72.85 3.15 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -176.189 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.41 141.49 28.58 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 114.18 -3.413 . . . . 0.0 112.27 179.447 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -137.27 100.15 4.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.579 0.704 . . . . 0.0 110.214 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.416 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.3 OUTLIER -58.16 -46.55 88.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.433 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -57.87 -31.93 67.19 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -178.024 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -70.82 -39.88 72.79 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 -176.961 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.42 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.42 -48.61 72.21 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.921 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.6 mt -56.83 -42.94 80.52 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -176.252 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -65.0 -38.44 90.97 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.424 0.63 . . . . 0.0 111.836 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.46 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -68.42 -47.53 67.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.579 0.704 . . . . 0.0 109.582 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.42 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -55.07 -48.11 73.95 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.875 177.743 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -63.96 -34.12 77.26 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -175.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -69.56 -46.88 65.37 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 176.295 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.408 HD21 HD23 ' A' ' 475' ' ' LEU . 1.1 tm? -58.44 -33.6 69.89 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.191 0.52 . . . . 0.0 110.901 -178.754 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.81 -18.29 63.95 Favored Glycine 0 C--O 1.235 0.191 0 CA-C-O 119.451 -0.638 . . . . 0.0 114.359 179.169 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.1 t -111.36 -12.44 14.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.911 0.856 . . . . 0.0 110.466 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.46 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.9 mt -68.87 146.48 52.79 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.982 -0.448 . . . . 0.0 110.228 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.416 ' O ' HD13 ' A' ' 512' ' ' ILE . 36.5 tt0 -79.22 84.4 5.18 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 122.762 1.267 . . . . 0.0 110.21 178.692 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.898 HG21 HD22 ' A' ' 546' ' ' LEU . 27.0 m -96.19 45.8 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 CA-C-O 122.8 1.286 . . . . 0.0 109.11 -178.547 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.1 t -66.47 171.31 5.08 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -177.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.5 m -49.26 -30.19 6.9 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -174.51 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -55.43 -45.71 76.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.522 0.201 . . . . 0.0 111.475 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -88.75 -40.3 13.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.283 0.563 . . . . 0.0 109.819 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.499 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.91 -34.93 75.42 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -174.941 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -64.62 -31.68 73.01 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.786 0.803 . . . . 0.0 111.817 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -95.34 -3.04 47.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.899 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -126.19 38.91 4.05 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.163 0.506 . . . . 0.0 110.526 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.5 p -63.81 -29.27 70.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -63.58 -26.74 68.83 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.586 0.708 . . . . 0.0 111.83 177.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.412 HG21 HD21 ' A' ' 475' ' ' LEU . 38.4 t -71.66 -42.85 71.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.2 t -62.82 -35.96 73.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.11 85.69 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.06 176.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 98.0 m -77.91 -38.54 45.44 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 118.958 0.799 . . . . 0.0 110.011 -179.503 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.531 HD23 HD11 ' A' ' 526' ' ' ILE . 45.0 mt -57.52 -35.13 69.87 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.01 0.433 . . . . 0.0 111.393 178.776 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -64.95 -29.03 69.93 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.948 -0.47 . . . . 0.0 111.538 175.567 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -73.43 -45.14 56.26 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.768 0.318 . . . . 0.0 111.259 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.531 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -77.06 -23.4 14.82 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.923 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -176.405 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.439 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.2 OUTLIER -60.2 -19.32 53.69 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 176.413 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -118.64 19.32 13.27 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.093 0.557 . . . . 0.0 111.897 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -63.59 109.68 1.74 Allowed 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -176.501 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -72.51 -29.27 63.46 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -177.691 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.65 -24.84 64.58 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -174.333 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -150.79 119.25 6.44 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.774 -0.371 . . . . 0.0 110.422 178.26 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -61.38 -45.94 92.27 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.121 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -56.89 -40.36 76.1 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.185 0.517 . . . . 0.0 111.515 -175.396 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.7 t -56.05 -45.09 80.34 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -64.55 -43.93 92.37 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 119.12 -0.467 . . . . 0.0 110.08 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.54 -47.59 78.21 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.305 -0.558 . . . . 0.0 111.99 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -68.72 -40.28 80.0 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 119.627 -0.829 . . . . 0.0 110.934 -178.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.94 86.89 Favored 'General case' 0 C--O 1.213 -0.852 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.439 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.12 -48.79 74.71 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.354 -0.839 . . . . 0.0 113.15 179.087 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -43.96 95.0 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 59.0 t -68.69 -50.13 58.14 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.676 -178.253 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -54.68 -45.03 73.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.657 0.265 . . . . 0.0 110.374 -177.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 10.3 m -67.15 -34.13 76.92 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.755 0.312 . . . . 0.0 111.273 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -60.76 -28.94 69.09 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.613 -0.68 . . . . 0.0 109.732 175.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.898 HD22 HG21 ' A' ' 508' ' ' VAL . 9.2 mt -76.39 -34.24 58.87 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -174.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -29.09 70.48 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.418 178.478 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 C--N 1.317 -0.827 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.456 176.822 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 8.9 m . . . . . 0 C--O 1.224 -0.251 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 35.6 t -53.86 -47.13 64.14 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.132 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.1 pt-20 -64.7 -34.31 78.01 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 120.718 0.294 . . . . 0.0 111.41 -176.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -67.25 -41.33 85.78 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.903 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -73.27 -33.61 65.35 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.891 -176.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.488 HD21 HG21 ' A' ' 519' ' ' VAL . 5.0 tt -56.74 -35.58 68.77 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.005 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -55.5 -41.02 72.49 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.253 0.479 . . . . 0.0 110.634 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -66.38 -54.68 21.59 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 177.376 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -47.23 85.18 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -176.505 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.477 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.6 t-160 -58.98 -43.08 91.34 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.706 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 62.2 m -64.13 -39.03 93.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 117.752 0.251 . . . . 0.0 111.619 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.401 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.3 mm-40 -64.23 -37.26 86.84 Favored 'General case' 0 CA--C 1.501 -0.935 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.595 179.001 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.14 -44.0 86.62 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.993 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 178.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.3 mmtt -62.94 -43.08 99.76 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.606 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -67.59 -34.12 76.38 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.73 0.3 . . . . 0.0 111.02 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.84 -15.29 63.52 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 29.7 mt -111.46 12.17 21.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.526 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -58.04 141.4 50.05 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 121.96 0.886 . . . . 0.0 109.562 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 70.7 t -65.42 -36.29 77.33 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 CA-C-N 113.86 -1.518 . . . . 0.0 107.808 174.024 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -74.92 -29.47 60.97 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.127 -1.851 . . . . 0.0 112.238 -173.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 10.2 t -165.98 79.54 1.14 Allowed Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.589 -175.228 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -73.07 142.5 34.52 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 115.082 -2.812 . . . . 0.0 112.163 176.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.4 t0 -137.13 100.34 4.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.451 0.643 . . . . 0.0 110.383 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.4 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.8 OUTLIER -55.5 -46.01 78.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -178.894 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -32.61 68.91 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-O 121.974 0.892 . . . . 0.0 109.933 -176.798 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -70.41 -40.55 73.8 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.269 -1.332 . . . . 0.0 108.633 -176.116 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.415 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.59 -50.31 65.57 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 175.305 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.7 mt -56.82 -42.83 80.3 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -65.52 -37.89 88.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.585 0.707 . . . . 0.0 111.655 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.77 -46.88 64.83 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.622 0.725 . . . . 0.0 109.694 178.172 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.415 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.92 -49.34 71.53 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.873 177.677 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -59.32 -36.58 75.91 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.8 -44.59 61.32 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.4 -34.79 72.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.059 0.457 . . . . 0.0 110.459 -178.36 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.46 -16.48 65.27 Favored Glycine 0 C--O 1.24 0.491 0 N-CA-C 115.359 0.904 . . . . 0.0 115.359 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.4 t -113.01 -12.19 13.26 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.413 0.607 . . . . 0.0 110.633 -179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -67.64 149.19 50.38 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.428 ' O ' HD13 ' A' ' 512' ' ' ILE . 37.1 tt0 -77.28 84.51 3.73 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-O 122.537 1.16 . . . . 0.0 108.979 177.701 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.87 HG21 HD22 ' A' ' 546' ' ' LEU . 26.9 m -98.73 47.59 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 CA-C-O 122.96 1.362 . . . . 0.0 108.194 -178.488 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.0 t -66.21 173.43 3.16 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 -179.246 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.8 m -49.33 -33.65 13.87 Favored 'General case' 0 C--O 1.211 -0.949 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -174.123 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -55.35 -45.44 76.47 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.202 -0.311 . . . . 0.0 111.771 177.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.428 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.1 mp -83.76 -42.52 17.4 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.597 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.424 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.92 -37.32 79.11 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -175.746 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -66.78 -32.89 74.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.477 0.18 . . . . 0.0 111.401 -179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -88.87 -6.44 57.32 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.843 179.215 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -129.89 44.35 2.98 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -178.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 32.3 p -64.88 -24.76 67.63 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.84 -33.26 75.59 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 122.399 1.095 . . . . 0.0 112.317 178.475 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.488 HG21 HD21 ' A' ' 475' ' ' LEU . 91.5 t -67.69 -43.18 86.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 520' ' ' VAL . . . . . 0.412 HG21 HD13 ' A' ' 513' ' ' LEU . 40.4 t -64.28 -37.45 79.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.91 -34.5 78.1 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.642 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 87.4 m -76.59 -39.64 51.98 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.58 HD23 HD11 ' A' ' 526' ' ' ILE . 51.9 mt -58.62 -34.79 71.55 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.1 0.476 . . . . 0.0 110.926 179.025 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -64.65 -29.18 70.18 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.912 -0.493 . . . . 0.0 111.32 175.086 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -73.05 -44.75 60.27 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 122.283 -0.261 . . . . 0.0 111.654 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.58 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.43 -20.57 13.27 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.905 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 -176.362 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.4 OUTLIER -62.19 -17.41 58.04 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 177.165 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -118.72 19.31 13.21 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.174 0.59 . . . . 0.0 112.128 176.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.434 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 13.2 t80 -63.8 117.68 7.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.06 0.457 . . . . 0.0 112.211 -177.482 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -75.97 -31.47 59.03 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.434 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -64.11 -41.73 97.14 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -173.303 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -133.21 118.27 18.42 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -178.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -58.8 -45.7 89.27 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.362 178.638 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -56.07 -41.75 75.59 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -176.336 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 68.6 t -56.57 -44.94 81.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.658 0 O-C-N 121.87 -0.519 . . . . 0.0 109.813 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.7 ttp -64.07 -43.89 94.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 119.167 -0.444 . . . . 0.0 109.846 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.89 -47.39 77.98 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.326 -0.55 . . . . 0.0 112.085 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -70.11 -37.96 75.5 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 119.089 -1.045 . . . . 0.0 111.253 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.54 -40.65 87.93 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.153 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.41 -49.23 72.35 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.543 179.038 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.36 -43.23 88.3 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 55.2 t -70.32 -49.98 49.87 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.041 0 C-N-CA 122.924 0.49 . . . . 0.0 111.318 -177.758 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -55.44 -45.82 76.81 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -178.144 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 17.6 m -66.18 -35.18 79.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.515 0.674 . . . . 0.0 111.029 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 13.1 mtt85 -60.82 -30.32 70.01 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.993 -0.442 . . . . 0.0 109.952 174.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.87 HD22 HG21 ' A' ' 508' ' ' VAL . 8.3 mt -76.55 -34.48 58.5 Favored 'General case' 0 C--O 1.208 -1.119 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 -176.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -28.19 69.22 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.587 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 25.2 m . . . . . 0 C--N 1.316 -0.877 0 CA-C-N 114.67 -1.15 . . . . 0.0 111.946 177.754 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 7.3 m . . . . . 0 C--O 1.223 -0.322 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.496 HG23 ' HB3' ' A' ' 506' ' ' LEU . 0.1 OUTLIER -53.06 -54.21 18.23 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.137 0 CA-C-O 121.967 0.889 . . . . 0.0 112.134 -179.627 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -54.24 -34.24 60.24 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 113.744 -1.571 . . . . 0.0 113.423 178.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -69.85 -43.8 71.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 122.531 1.157 . . . . 0.0 108.167 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -70.06 -32.77 71.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.564 -177.245 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.722 HD21 HG21 ' A' ' 519' ' ' VAL . 2.5 tt -56.99 -35.66 69.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.447 178.191 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -58.5 -40.75 83.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.523 0.601 . . . . 0.0 109.92 178.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -66.85 -54.89 17.86 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 110.334 -0.247 . . . . 0.0 110.334 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -43.31 90.98 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.569 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.481 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.5 t-160 -57.31 -44.05 83.78 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.9 m -63.95 -38.5 91.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.485 0.18 . . . . 0.0 111.485 -179.527 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -63.3 -38.65 91.98 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.28 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.9 mt -58.22 -43.95 86.86 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -62.85 -44.74 95.32 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -178.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -66.36 -31.8 72.8 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.023 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.2 -18.39 65.23 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.897 0.702 . . . . 0.0 112.897 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 486' ' ' LEU . . . . . 0.41 HD11 ' CG2' ' A' ' 526' ' ' ILE . 20.9 mt -106.84 12.14 29.29 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -177.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -54.72 130.15 39.52 Favored 'General case' 0 C--O 1.208 -1.119 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 178.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 55.8 t -63.5 -42.2 95.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 122.056 0.931 . . . . 0.0 109.471 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -67.6 -30.86 70.56 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 113.979 -1.464 . . . . 0.0 112.975 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 13.8 t -160.08 77.55 2.73 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.002 -175.416 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.61 149.23 34.01 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 117.123 -1.451 . . . . 0.0 112.383 179.046 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -137.21 97.77 3.57 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.857 0.836 . . . . 0.0 110.078 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.7 OUTLIER -58.22 -46.36 88.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -179.212 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -59.74 -31.38 69.58 Favored 'General case' 0 CA--C 1.504 -0.811 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -177.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -69.08 -41.6 77.32 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.53 -47.89 77.12 Favored 'General case' 0 C--O 1.21 -1.021 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 175.912 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 84.6 mt -57.68 -44.06 85.52 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 118.045 0.384 . . . . 0.0 111.346 -176.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -63.07 -40.88 99.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.735 0.779 . . . . 0.0 110.901 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.14 -46.65 73.44 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.762 0.791 . . . . 0.0 109.529 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.401 HD23 ' HB3' ' A' ' 538' ' ' LYS . 0.0 OUTLIER -56.11 -51.16 68.91 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.337 178.339 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -61.44 -35.66 78.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -175.142 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.26 -43.25 64.6 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 118.775 -1.17 . . . . 0.0 108.473 177.585 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -33.31 67.6 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.359 0.599 . . . . 0.0 109.895 178.385 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.62 -17.68 69.21 Favored Glycine 0 C--O 1.238 0.379 0 N-CA-C 114.833 0.693 . . . . 0.0 114.833 179.502 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.3 t -110.5 -14.83 14.03 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 117.714 0.757 . . . . 0.0 110.402 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.496 ' HB3' HG23 ' A' ' 471' ' ' VAL . 2.4 mt -66.51 149.28 50.68 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.008 -0.433 . . . . 0.0 110.211 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.415 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.1 tt0 -78.76 84.4 4.83 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-O 122.324 1.059 . . . . 0.0 111.916 -178.783 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.504 HG21 HD22 ' A' ' 546' ' ' LEU . 17.5 m -106.93 76.9 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 CA-C-O 126.897 3.237 . . . . 0.0 106.514 176.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.3 t -88.46 171.59 9.99 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 110.235 -3.166 . . . . 0.0 103.677 172.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.26 -34.61 15.6 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.49 -41.51 73.13 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.415 HD13 ' O ' ' A' ' 507' ' ' GLN . 3.8 mp -88.74 -39.65 12.72 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.822 0 CA-C-O 122.483 1.135 . . . . 0.0 108.912 -178.644 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 31.1 mt -60.78 -39.65 89.65 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.139 -174.214 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -63.44 -34.82 78.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -89.95 -8.06 52.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.24 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -125.92 37.83 4.27 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.428 0.632 . . . . 0.0 110.711 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 3.6 p -61.1 -28.11 68.85 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -178.084 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.57 -30.46 71.57 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.426 0.631 . . . . 0.0 112.136 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.722 HG21 HD21 ' A' ' 475' ' ' LEU . 34.0 t -74.24 -42.94 50.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.38 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.7 t -61.94 -37.75 79.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.613 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.86 -37.76 88.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.734 177.154 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 95.6 m -71.23 -39.31 71.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.679 HD23 HD11 ' A' ' 526' ' ' ILE . 70.0 mt -59.67 -35.75 75.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.199 0.523 . . . . 0.0 110.362 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -65.2 -29.09 69.87 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.947 -0.471 . . . . 0.0 111.254 175.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -72.18 -45.62 59.65 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 122.098 -0.376 . . . . 0.0 111.349 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.679 HD11 HD23 ' A' ' 523' ' ' LEU . 17.1 pt -78.79 -18.1 13.3 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.864 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -176.672 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.468 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.79 -15.93 59.94 Favored 'General case' 0 C--O 1.212 -0.899 0 O-C-N 121.965 -0.459 . . . . 0.0 111.503 176.287 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -118.72 17.94 13.47 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 122.774 0.429 . . . . 0.0 111.241 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.41 ' CE2' ' HB3' ' A' ' 531' ' ' ALA . 14.7 t80 -63.02 123.65 19.11 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.667 0.387 . . . . 0.0 110.207 -178.346 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -92.4 -21.92 19.94 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 -175.863 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.41 ' HB3' ' CE2' ' A' ' 529' ' ' TYR . . . -65.89 -41.61 91.31 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.265 0.555 . . . . 0.0 110.589 -177.58 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -130.26 115.55 17.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.025 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.6 tptt -55.76 -47.95 76.13 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.222 177.785 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -54.99 -42.81 72.95 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -175.352 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.7 t -56.68 -45.08 82.57 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 O-C-N 122.016 -0.428 . . . . 0.0 109.887 177.164 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.4 ttp -65.04 -43.79 91.19 Favored 'General case' 0 CA--C 1.51 -0.59 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.56 -48.6 76.78 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 538' ' ' LYS . . . . . 0.401 ' HB3' HD23 ' A' ' 500' ' ' LEU . 44.0 tptt -71.0 -38.36 72.66 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.282 -178.085 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.52 -39.96 85.58 Favored 'General case' 0 CA--C 1.501 -0.926 0 CA-C-O 121.625 0.726 . . . . 0.0 109.044 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.468 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.89 -49.04 76.4 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.535 -1.211 . . . . 0.0 113.052 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.81 -41.35 91.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 51.2 t -70.45 -51.99 33.13 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.021 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.676 -177.562 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -54.59 -45.05 73.51 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.633 0.254 . . . . 0.0 110.317 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 20.5 m -65.93 -36.03 82.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.886 0.374 . . . . 0.0 111.248 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -59.37 -30.74 68.62 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.038 -0.413 . . . . 0.0 110.26 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.504 HD22 HG21 ' A' ' 508' ' ' VAL . 6.3 mt -76.63 -32.81 58.26 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 -176.628 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.71 -30.22 71.35 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.67 179.46 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 36.2 m . . . . . 0 C--N 1.316 -0.878 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.706 176.872 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.3 m . . . . . 0 C--O 1.225 -0.21 0 CA-C-O 121.054 0.454 . . . . 0.0 111.798 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.435 HG13 ' HB3' ' A' ' 506' ' ' LEU . 44.0 t -54.8 -46.9 75.04 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 179.478 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.412 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.9 OUTLIER -62.24 -34.35 76.34 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -178.454 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -67.91 -41.2 83.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.579 1.181 . . . . 0.0 108.184 179.698 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 474' ' ' LYS . . . . . 0.405 ' O ' HD22 ' A' ' 478' ' ' LEU . 58.2 mtpt -72.9 -35.31 67.06 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.569 -177.876 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.5 HD21 HG21 ' A' ' 519' ' ' VAL . 3.8 tt -57.92 -36.66 72.8 Favored 'General case' 0 C--O 1.211 -0.933 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.361 178.464 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -57.32 -42.42 81.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.835 0.743 . . . . 0.0 110.124 177.909 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -67.44 -54.33 21.23 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.645 178.118 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 478' ' ' LEU . . . . . 0.405 HD22 ' O ' ' A' ' 474' ' ' LYS . 0.1 OUTLIER -58.27 -44.85 88.62 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -178.465 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.426 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.6 t-160 -57.79 -44.5 86.31 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -179.89 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.2 m -62.84 -39.3 93.94 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.623 0.231 . . . . 0.0 111.623 -179.03 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.456 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 14.6 mm-40 -63.98 -37.53 87.77 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.396 178.507 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.4 mt -58.99 -43.53 89.08 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 178.876 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -64.01 -44.06 93.76 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 122.082 -0.386 . . . . 0.0 112.003 -178.875 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -65.83 -32.8 74.52 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.75 -178.876 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.89 -16.67 64.19 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 179.224 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 35.2 mt -110.51 12.21 22.91 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -177.224 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 50.0 mttt -55.26 132.65 48.32 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.255 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.9 t -64.17 -41.71 93.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 122.343 1.068 . . . . 0.0 108.484 176.808 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -68.14 -29.75 68.71 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 113.574 -1.648 . . . . 0.0 113.281 -178.417 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 10.8 t -160.69 75.99 2.65 Favored Pre-proline 0 N--CA 1.469 0.513 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -175.662 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.36 145.87 30.75 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 117.203 -1.398 . . . . 0.0 113.206 178.915 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -137.32 100.66 4.3 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.286 0.565 . . . . 0.0 111.092 178.826 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.441 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.5 OUTLIER -56.66 -45.36 82.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -179.341 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 10.9 pttt -59.33 -32.53 70.17 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 121.89 0.852 . . . . 0.0 109.605 -176.919 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -70.39 -40.8 73.73 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.417 -1.265 . . . . 0.0 108.816 -176.473 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.81 -48.5 71.5 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 175.887 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.8 mt -56.93 -43.39 81.44 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -176.724 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -65.42 -37.9 88.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.488 0.661 . . . . 0.0 111.745 179.608 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.456 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.33 -46.67 66.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.721 0.772 . . . . 0.0 109.682 178.363 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -49.39 72.75 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.396 178.938 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -61.46 -34.66 75.83 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -175.238 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -45.71 60.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 176.731 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.93 -33.51 68.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.465 0.65 . . . . 0.0 109.868 -178.691 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.93 -17.87 68.05 Favored Glycine 0 C--O 1.236 0.251 0 CA-C-O 119.206 -0.775 . . . . 0.0 114.852 179.423 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.7 t -112.53 -6.23 13.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.345 1.073 . . . . 0.0 110.894 -179.733 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.435 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.0 mt -72.49 150.16 43.5 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.05 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -78.84 84.46 4.89 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-O 122.671 1.224 . . . . 0.0 109.213 178.145 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.897 HG21 HD22 ' A' ' 546' ' ' LEU . 27.1 m -98.63 50.72 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-O 123.536 1.636 . . . . 0.0 109.115 -177.379 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 3.7 t -64.51 167.83 6.62 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 -179.514 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.7 m -49.25 -32.16 10.16 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -176.185 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -55.38 -44.7 76.31 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 178.28 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.0 mp -85.97 -43.46 16.46 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-O 121.961 0.886 . . . . 0.0 108.887 179.86 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.57 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.13 -39.91 79.91 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -175.182 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -72.7 -28.51 62.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.346 -176.767 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -88.99 -8.25 54.45 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.862 176.709 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -125.1 40.97 3.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.631 0.729 . . . . 0.0 111.735 -179.066 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 10.7 p -62.75 -24.48 67.72 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -179.103 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.62 -30.86 71.92 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.45 0.643 . . . . 0.0 112.037 177.954 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.5 HG21 HD21 ' A' ' 475' ' ' LEU . 22.6 t -71.87 -41.34 69.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.89 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 520' ' ' VAL . . . . . 0.418 HG21 HD13 ' A' ' 513' ' ' LEU . 29.9 t -63.22 -37.98 80.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.681 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.93 -32.59 74.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.653 177.737 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.4 m -79.49 -40.22 30.24 Favored 'General case' 0 C--O 1.217 -0.632 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.512 HD23 HD11 ' A' ' 526' ' ' ILE . 38.7 mt -57.61 -35.41 70.42 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.114 0.483 . . . . 0.0 111.039 178.57 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -63.97 -29.05 70.24 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.07 -0.394 . . . . 0.0 111.533 175.175 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -74.13 -45.42 48.98 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.272 -0.268 . . . . 0.0 111.547 178.655 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.512 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -77.53 -21.23 14.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.932 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 -176.427 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -61.56 -18.87 61.12 Favored 'General case' 0 C--O 1.211 -0.959 0 O-C-N 121.961 -0.462 . . . . 0.0 111.658 176.056 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.75 19.44 13.15 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.154 0.582 . . . . 0.0 111.965 177.15 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.435 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 10.1 t80 -59.97 123.32 16.72 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.136 0.493 . . . . 0.0 111.629 -177.805 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -81.79 -28.46 33.18 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -176.744 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.435 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -69.17 -38.81 78.9 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -174.721 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -135.05 121.38 20.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.768 0.318 . . . . 0.0 110.765 -177.937 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.7 tptt -64.17 -40.32 95.87 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 178.221 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -46.97 73.88 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 123.341 0.656 . . . . 0.0 111.467 -176.525 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.0 t -58.73 -44.75 90.74 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.904 178.331 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -62.11 -44.2 97.16 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.97 -47.45 77.53 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.419 -0.512 . . . . 0.0 112.229 179.814 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -70.18 -38.21 75.34 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 118.408 -1.317 . . . . 0.0 111.285 -178.75 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.4 -39.73 84.34 Favored 'General case' 0 C--O 1.213 -0.832 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.365 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.421 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.91 -48.93 72.4 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.813 -1.085 . . . . 0.0 113.036 178.756 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -41.62 89.55 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.84 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.9 t -70.52 -50.33 46.08 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.013 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.937 -178.276 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -55.49 -44.74 76.81 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 -178.211 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.1 m -66.63 -35.57 80.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.263 0.554 . . . . 0.0 111.131 179.184 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 15.5 mtt85 -61.2 -29.43 69.81 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.879 -0.513 . . . . 0.0 109.99 175.217 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.897 HD22 HG21 ' A' ' 508' ' ' VAL . 8.8 mt -76.6 -36.03 57.76 Favored 'General case' 0 C--O 1.205 -1.268 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -177.555 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -30.1 70.24 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.588 178.931 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.4 m . . . . . 0 C--N 1.318 -0.801 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.108 178.483 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 C--O 1.225 -0.186 0 CA-C-O 121.027 0.441 . . . . 0.0 111.86 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.441 HG13 HD23 ' A' ' 506' ' ' LEU . 45.0 t -56.09 -47.93 79.74 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.929 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -179.749 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.4 OUTLIER -64.94 -34.26 78.0 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -178.57 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -66.49 -43.59 84.98 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.024 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 19.7 mttt -69.37 -33.75 73.53 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.368 -178.02 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -56.71 -38.88 72.93 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.607 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.98 -40.22 69.84 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.992 -178.862 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -67.02 -55.06 16.0 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 176.89 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -46.14 90.63 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -176.712 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -61.45 -39.5 91.05 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.644 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 65.2 m -65.11 -41.17 95.17 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.556 179.164 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.13 -42.64 99.56 Favored 'General case' 0 CA--C 1.501 -0.934 0 C-N-CA 120.976 -0.289 . . . . 0.0 111.19 178.388 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -54.65 -46.64 73.16 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.269 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.683 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 43.6 mtpt -67.81 -38.85 83.81 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -177.425 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -67.32 -32.92 74.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.895 0.379 . . . . 0.0 110.198 178.099 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.0 -19.68 66.12 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 178.955 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 25.4 mt -105.22 12.16 32.21 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.386 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 29.4 mtpt -55.66 130.38 42.92 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.564 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 44.9 t -63.6 -40.51 89.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 122.395 1.093 . . . . 0.0 108.931 177.992 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -30.44 71.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.568 -1.651 . . . . 0.0 113.016 -178.24 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 2.7 p -163.08 79.66 1.68 Allowed Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.343 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.04 146.28 51.9 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 116.938 -1.575 . . . . 0.0 112.265 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -137.22 92.65 2.73 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.513 0.673 . . . . 0.0 109.921 -175.714 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.418 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.9 OUTLIER -58.9 -45.0 92.06 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.798 0 N-CA-C 113.391 0.885 . . . . 0.0 113.391 -177.229 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -57.12 -31.9 65.78 Favored 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -178.885 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -71.03 -41.47 70.81 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.675 -177.87 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.474 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -63.92 -48.61 75.9 Favored 'General case' 0 C--O 1.211 -0.942 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 176.7 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 81.2 mt -57.99 -44.19 87.01 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 117.863 0.301 . . . . 0.0 111.619 -176.935 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.16 -39.07 91.4 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.622 0.725 . . . . 0.0 110.735 178.88 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.82 -49.33 62.83 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.357 0.598 . . . . 0.0 109.796 178.816 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.474 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.06 -45.43 83.24 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.52 178.282 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -65.35 -33.31 75.66 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 121.243 -0.91 . . . . 0.0 112.504 -176.848 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -67.8 -49.37 62.71 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 105.307 -2.108 . . . . 0.0 105.307 175.395 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -30.63 33.53 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.54 0.686 . . . . 0.0 111.119 -177.64 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -62.97 -28.36 71.88 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 114.894 0.718 . . . . 0.0 114.894 178.163 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 8.0 t -100.86 -26.36 13.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 117.745 0.773 . . . . 0.0 110.808 -179.342 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.441 HD23 HG13 ' A' ' 471' ' ' VAL . 3.0 mp -55.46 136.01 50.04 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 176.362 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -78.81 84.37 4.87 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-O 122.975 1.369 . . . . 0.0 110.416 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.919 HG21 HD22 ' A' ' 546' ' ' LEU . 27.4 m -95.7 48.5 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.325 0 CA-C-O 122.963 1.363 . . . . 0.0 108.734 -178.988 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 8.9 t -66.92 171.64 5.21 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 -178.219 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.23 -30.74 7.52 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -174.369 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -55.48 -46.55 76.87 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.391 -0.193 . . . . 0.0 111.519 177.052 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -87.12 -41.05 14.42 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 CA-C-O 121.511 0.672 . . . . 0.0 109.695 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.507 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.7 -36.18 76.0 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -174.894 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -65.4 -32.27 73.81 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.755 0.788 . . . . 0.0 111.722 -178.679 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -95.76 -0.33 51.49 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.801 -179.229 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -133.01 42.59 3.04 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.568 0.699 . . . . 0.0 111.613 179.175 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.2 p -64.14 -27.21 68.93 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -179.122 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -65.04 -24.43 67.48 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.654 0.74 . . . . 0.0 111.938 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 55.4 t -70.55 -43.53 77.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 179.173 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 28.8 t -64.21 -36.17 76.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.238 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.26 -38.27 88.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.813 177.325 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.4 m -76.08 -38.6 56.84 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 118.874 0.761 . . . . 0.0 109.861 -179.551 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.587 HD23 HD11 ' A' ' 526' ' ' ILE . 49.5 mt -58.15 -35.19 71.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.02 0.438 . . . . 0.0 111.226 178.639 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -64.46 -29.18 70.23 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.993 -0.442 . . . . 0.0 111.465 175.129 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -73.04 -46.31 52.54 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 117.767 0.258 . . . . 0.0 111.423 178.845 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.587 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -77.21 -20.52 14.3 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -176.106 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.419 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -62.44 -15.82 51.63 Favored 'General case' 0 C--O 1.212 -0.885 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 177.259 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 11.6 ptp85 -118.69 19.34 13.23 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.031 0.533 . . . . 0.0 111.458 175.891 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -64.07 105.69 0.92 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -175.72 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -70.09 -30.14 67.29 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -176.703 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.74 -27.5 66.85 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -174.637 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -147.69 113.74 5.82 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.096 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 41.8 tptt -56.71 -45.46 81.87 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.531 -178.294 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -56.48 -40.68 75.32 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.987 0.422 . . . . 0.0 112.003 -175.836 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -56.84 -45.1 83.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 177.384 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -64.84 -43.41 93.14 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 119.192 -0.432 . . . . 0.0 110.241 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.48 -48.17 76.2 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.409 -0.517 . . . . 0.0 112.005 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 31.4 tptt -68.62 -39.48 80.78 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.071 -178.841 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.63 -40.82 84.46 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-O 121.306 0.574 . . . . 0.0 109.518 177.827 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.419 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.5 -48.27 75.78 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.247 -0.888 . . . . 0.0 113.296 179.433 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -42.24 93.67 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.1 t -70.65 -50.09 47.09 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.8 -178.579 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -54.79 -45.46 74.33 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.733 0.301 . . . . 0.0 110.193 -177.351 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.6 m -66.82 -33.97 76.77 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.397 0.617 . . . . 0.0 111.312 179.916 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 13.1 mtt85 -61.35 -29.81 70.13 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 121.796 -0.565 . . . . 0.0 109.96 174.885 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.919 HD22 HG21 ' A' ' 508' ' ' VAL . 9.0 mt -76.52 -34.01 58.58 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -175.208 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -27.87 69.63 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.961 178.08 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 C--N 1.316 -0.891 0 CA-C-N 114.607 -1.179 . . . . 0.0 112.075 177.505 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 121.006 0.431 . . . . 0.0 111.777 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.403 HG13 HD23 ' A' ' 506' ' ' LEU . 56.0 t -54.61 -47.18 72.71 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.792 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.681 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -65.07 -33.78 76.86 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -178.53 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.11 -41.74 85.72 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.97 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -72.43 -32.73 66.55 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.863 -177.852 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -57.42 -39.17 75.64 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.306 -179.541 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -53.76 -38.84 64.82 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.969 -178.878 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -70.42 -55.38 9.19 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.444 176.424 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.9 -45.89 82.31 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -176.397 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 17.9 t-160 -62.02 -38.79 90.0 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.477 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 52.0 m -65.39 -41.31 93.81 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.357 178.696 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 7.1 mm-40 -63.81 -42.41 97.68 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 117.938 0.336 . . . . 0.0 111.255 178.742 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.52 -46.74 71.73 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 177.329 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 50.1 mtpt -68.14 -38.63 82.39 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.163 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -66.58 -32.68 74.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 177.934 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.78 -19.41 65.88 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 178.959 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 21.6 mt -104.11 12.1 34.36 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -56.47 129.44 40.73 Favored 'General case' 0 C--O 1.208 -1.114 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 178.126 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 57.0 t -62.41 -39.84 85.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 122.44 1.114 . . . . 0.0 108.242 177.229 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.36 -28.75 69.5 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 113.272 -1.786 . . . . 0.0 113.165 -179.506 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 95.9 p -163.03 76.68 1.87 Allowed Pre-proline 0 C--O 1.241 0.627 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.017 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.82 144.97 49.78 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 114.701 -3.066 . . . . 0.0 111.895 179.469 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -137.21 91.53 2.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.755 0.788 . . . . 0.0 110.228 -174.851 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.414 HG12 ' H ' ' A' ' 493' ' ' VAL . 1.0 OUTLIER -57.29 -45.65 85.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -177.636 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.72 -30.47 68.84 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -178.0 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -71.01 -41.64 70.65 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -178.501 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.476 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.23 -48.31 76.32 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.458 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 94.0 mt -57.64 -42.55 83.65 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 117.627 0.194 . . . . 0.0 111.464 -177.343 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -64.8 -39.1 93.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.3 0.572 . . . . 0.0 111.25 178.382 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -65.82 -48.67 70.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 177.995 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.476 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -58.53 -44.57 89.62 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.505 178.822 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.27 -33.18 75.22 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 119.086 0.857 . . . . 0.0 111.544 -177.085 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -50.85 37.52 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 106.074 -1.825 . . . . 0.0 106.074 175.065 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.27 -30.72 18.74 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.211 0.529 . . . . 0.0 112.308 -177.479 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.64 -28.03 73.21 Favored Glycine 0 C--O 1.24 0.501 0 N-CA-C 114.91 0.724 . . . . 0.0 114.91 177.608 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 9.0 t -100.36 -25.94 14.05 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.322 0.561 . . . . 0.0 110.67 -177.844 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.403 HD23 HG13 ' A' ' 471' ' ' VAL . 3.0 mp -56.11 137.11 52.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 O-C-N 121.789 -0.569 . . . . 0.0 112.389 174.825 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.449 ' O ' HD13 ' A' ' 512' ' ' ILE . 30.3 tt0 -78.97 80.23 5.33 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 122.588 1.185 . . . . 0.0 109.795 -179.422 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.817 HG21 HD22 ' A' ' 546' ' ' LEU . 30.9 m -93.33 49.76 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 CA-C-O 123.248 1.499 . . . . 0.0 108.081 -179.731 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.6 t -66.96 174.95 2.72 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 113.859 -1.518 . . . . 0.0 107.122 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 21.0 m -49.29 -36.16 20.05 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -173.577 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -53.72 -44.54 69.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 178.42 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.449 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -88.57 -40.29 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 -179.33 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.436 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.71 -39.81 81.89 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -176.261 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -68.89 -31.09 69.76 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.757 -0.202 . . . . 0.0 111.358 -178.375 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -90.04 -2.38 58.11 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 122.235 -0.291 . . . . 0.0 111.328 177.572 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -129.91 46.51 2.64 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.698 0.761 . . . . 0.0 111.802 179.046 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.2 p -64.6 -28.83 69.89 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 121.713 -0.617 . . . . 0.0 112.307 -179.29 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -65.41 -28.56 69.34 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.393 0.616 . . . . 0.0 111.715 177.851 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 59.5 t -68.9 -44.52 81.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.782 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 34.4 t -62.56 -36.36 74.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.211 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.6 -40.1 95.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 119.345 -0.36 . . . . 0.0 110.7 177.309 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 93.6 m -72.77 -39.71 66.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 118.704 0.684 . . . . 0.0 110.532 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.665 HD23 HD11 ' A' ' 526' ' ' ILE . 68.9 mt -57.76 -35.02 70.19 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.903 0.382 . . . . 0.0 111.133 178.828 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -65.41 -29.05 69.71 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.691 -0.631 . . . . 0.0 111.527 175.928 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -73.05 -46.03 54.09 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.022 0.439 . . . . 0.0 110.798 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.665 HD11 HD23 ' A' ' 523' ' ' LEU . 15.2 pt -77.39 -21.44 14.19 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 -175.843 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.469 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -62.49 -18.86 62.81 Favored 'General case' 0 C--O 1.212 -0.888 0 O-C-N 121.94 -0.475 . . . . 0.0 111.422 175.89 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.77 18.98 13.27 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 122.846 0.458 . . . . 0.0 111.101 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -63.04 119.95 10.47 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 122.612 0.365 . . . . 0.0 110.69 -178.479 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -88.45 -23.29 23.31 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 115.437 1.643 . . . . 0.0 115.437 -175.598 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.01 -41.22 91.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.245 0.545 . . . . 0.0 110.993 -177.641 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -130.8 112.64 13.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.91 -179.048 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -56.78 -43.65 81.06 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.889 179.086 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -55.79 -41.86 74.72 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -176.628 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.2 t -58.19 -43.33 85.45 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.092 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -64.17 -44.03 93.32 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 179.786 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -63.56 -48.91 75.52 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.958 -179.606 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -70.54 -39.04 74.23 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 118.717 -1.193 . . . . 0.0 111.132 -177.516 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.43 -39.56 83.93 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 121.355 0.598 . . . . 0.0 109.789 178.572 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.58 -46.2 83.74 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.28 -0.873 . . . . 0.0 113.172 178.745 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -40.42 90.67 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.006 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 55.6 t -70.68 -53.62 21.45 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.359 -178.793 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -53.94 -44.94 71.09 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 122.293 0.237 . . . . 0.0 110.734 -175.027 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 28.0 m -64.2 -38.79 92.33 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 123.203 0.601 . . . . 0.0 111.125 179.136 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 40.6 mtt85 -61.91 -30.65 71.04 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 121.748 -0.595 . . . . 0.0 110.909 176.923 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.817 HD22 HG21 ' A' ' 508' ' ' VAL . 5.8 mt -75.6 -31.73 60.05 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 -177.149 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -36.57 78.72 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.974 176.014 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 CA--C 1.539 0.534 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 177.02 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 N--CA 1.461 0.121 0 CA-C-O 121.088 0.471 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.407 HG13 ' HB3' ' A' ' 506' ' ' LEU . 45.2 t -55.43 -46.17 78.53 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.047 0 O-C-N 122.212 -0.305 . . . . 0.0 111.543 179.095 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.418 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -64.69 -35.25 80.43 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -177.529 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.56 -42.08 87.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.84 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -69.22 -38.12 78.38 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 121.546 0.688 . . . . 0.0 109.503 -179.154 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.613 HD21 HG21 ' A' ' 519' ' ' VAL . 4.5 tt -57.73 -35.58 70.88 Favored 'General case' 0 C--O 1.209 -1.045 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.727 179.424 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -57.58 -41.31 80.89 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 119.366 0.984 . . . . 0.0 110.402 178.066 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -67.39 -53.22 31.19 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.721 178.427 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -45.22 88.81 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.892 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.464 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.0 t-160 -58.17 -44.8 88.15 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -179.846 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.1 m -62.69 -39.07 92.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 -179.125 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.415 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 13.3 mm-40 -64.11 -37.62 88.12 Favored 'General case' 0 CA--C 1.505 -0.764 0 C-N-CA 120.516 -0.473 . . . . 0.0 110.49 178.346 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.4 mt -59.09 -43.39 89.1 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.954 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 178.845 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -63.04 -45.32 92.81 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 122.127 -0.358 . . . . 0.0 111.855 -179.485 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -65.71 -33.24 75.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.734 0.302 . . . . 0.0 111.121 -178.524 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.15 -15.99 64.05 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 179.37 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 36.0 mt -111.87 12.1 20.82 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -177.914 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt -54.23 129.48 35.22 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 177.434 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.39 -40.33 83.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 122.73 1.253 . . . . 0.0 107.893 177.001 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.84 -24.63 64.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 112.959 -1.928 . . . . 0.0 113.348 179.944 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 7.1 m -159.58 71.74 3.3 Favored Pre-proline 0 N--CA 1.475 0.788 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -176.778 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -71.49 139.82 35.2 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 114.142 -3.438 . . . . 0.0 112.006 179.144 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -137.14 95.85 3.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.529 0.681 . . . . 0.0 111.583 -177.649 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.409 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.5 OUTLIER -55.12 -48.88 75.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -176.871 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 19.8 pttm -58.61 -32.55 69.11 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-O 122.533 1.159 . . . . 0.0 110.503 -175.566 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -67.86 -42.17 81.75 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.194 -178.144 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.4 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.8 -48.34 74.79 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.733 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 75.5 mt -56.76 -43.19 80.55 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -176.125 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -64.64 -38.77 92.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.639 0.733 . . . . 0.0 111.95 179.384 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.85 -44.87 69.0 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.468 0.652 . . . . 0.0 109.551 179.333 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.4 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.05 -49.8 72.73 Favored 'General case' 0 N--CA 1.428 -1.564 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.463 177.224 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -62.4 -34.86 77.56 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -175.376 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -67.8 -48.22 66.88 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 176.367 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -32.21 66.46 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.291 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.6 -15.66 66.64 Favored Glycine 0 N--CA 1.453 -0.222 0 CA-C-O 119.104 -0.831 . . . . 0.0 114.382 179.129 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.5 t -114.54 -13.72 12.16 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.482 1.141 . . . . 0.0 110.968 179.518 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.407 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.0 mt -67.29 148.25 51.93 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.818 -0.551 . . . . 0.0 110.558 179.472 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -77.83 84.41 4.14 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 122.738 1.256 . . . . 0.0 109.936 178.261 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.911 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -98.35 50.11 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-O 123.228 1.489 . . . . 0.0 109.138 -177.597 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.1 t -68.58 171.89 6.97 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 106.567 -1.642 . . . . 0.0 106.567 -179.195 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.28 -33.49 13.14 Favored 'General case' 0 C--O 1.218 -0.596 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -174.109 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -54.19 -44.39 71.51 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 111.441 0.163 . . . . 0.0 111.441 178.378 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.5 mp -88.52 -43.13 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-O 121.337 0.589 . . . . 0.0 110.088 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.526 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.9 -40.37 84.26 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -175.527 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -71.14 -28.64 64.43 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.136 -176.35 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -89.76 -5.55 56.85 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 122.332 -0.23 . . . . 0.0 111.169 176.903 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -127.44 42.55 3.3 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.854 0.835 . . . . 0.0 112.505 179.93 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 17.8 p -63.86 -24.01 67.58 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -179.264 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.54 -32.27 73.85 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.314 1.054 . . . . 0.0 112.213 178.293 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.613 HG21 HD21 ' A' ' 475' ' ' LEU . 61.3 t -69.6 -42.58 80.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 179.118 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 48.5 t -63.2 -37.47 79.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.079 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.41 -33.13 74.88 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.655 178.029 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.7 m -79.29 -39.38 33.08 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.904 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.526 HD23 HD11 ' A' ' 526' ' ' ILE . 40.7 mt -57.43 -34.7 69.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.985 0.421 . . . . 0.0 111.431 178.22 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -63.87 -29.2 70.41 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.781 -0.574 . . . . 0.0 111.568 175.157 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -74.77 -43.34 55.33 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.603 0.239 . . . . 0.0 111.611 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.526 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -78.78 -21.82 12.93 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.952 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -177.373 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.418 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -60.65 -17.91 50.3 Favored 'General case' 0 C--O 1.211 -0.924 0 O-C-N 122.032 -0.417 . . . . 0.0 112.091 176.357 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -118.71 19.35 13.21 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.053 0.541 . . . . 0.0 111.269 178.005 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -65.7 115.34 5.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.167 0.508 . . . . 0.0 111.46 -176.968 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -82.91 -23.6 33.46 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 -176.488 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.54 -40.33 92.78 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.972 -177.093 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -133.22 113.23 12.43 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.87 -178.773 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.1 tptt -56.05 -44.66 79.06 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.565 178.728 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -55.32 -43.15 74.65 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -176.731 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 76.0 t -57.91 -43.93 85.56 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 177.477 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -62.97 -44.69 95.36 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 119.333 -0.365 . . . . 0.0 110.04 179.414 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.91 -47.51 77.5 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.5 tptt -69.33 -39.24 78.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.115 -1.034 . . . . 0.0 111.28 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.92 85.94 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.263 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.418 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.73 -48.82 75.47 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.774 -1.103 . . . . 0.0 113.142 178.863 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -43.32 92.6 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.841 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 78.8 t -68.94 -50.55 53.06 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.877 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.162 -178.416 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -55.03 -43.86 74.09 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.611 0.243 . . . . 0.0 110.446 -177.692 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 16.5 m -67.57 -35.82 79.74 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 122.641 0.377 . . . . 0.0 111.123 179.265 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.52 -31.85 69.77 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 176.182 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.911 HD22 HG21 ' A' ' 508' ' ' VAL . 5.5 mt -75.08 -36.73 61.72 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -176.327 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -56.45 -37.68 70.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.629 179.429 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 13.8 m . . . . . 0 C--N 1.322 -0.598 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 178.421 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.4 m . . . . . 0 C--O 1.224 -0.263 0 CA-C-O 120.998 0.427 . . . . 0.0 111.784 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 471' ' ' VAL . . . . . 0.427 HG13 ' HB3' ' A' ' 506' ' ' LEU . 32.7 t -53.89 -47.6 63.92 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 O-C-N 122.007 -0.433 . . . . 0.0 111.97 179.399 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -62.31 -33.68 75.13 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.428 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -67.28 -40.8 86.16 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -179.565 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -74.21 -35.58 63.92 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.409 -178.034 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.622 HD21 HG21 ' A' ' 519' ' ' VAL . 3.7 tt -58.63 -37.2 75.39 Favored 'General case' 0 C--O 1.206 -1.197 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.237 178.369 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -59.07 -40.85 86.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 119.036 0.835 . . . . 0.0 110.61 178.422 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -64.82 -53.13 51.7 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.789 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -44.57 93.89 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.079 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.424 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.4 t-160 -57.9 -44.79 86.99 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -178.898 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.7 m -62.77 -39.63 94.8 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.181 0.301 . . . . 0.0 111.622 -179.325 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -64.41 -37.25 86.86 Favored 'General case' 0 CA--C 1.504 -0.81 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.625 178.337 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.8 mt -59.14 -43.47 89.48 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.031 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 178.872 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.7 mmtt -63.68 -46.02 87.43 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.37 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -64.81 -33.04 75.05 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 120.8 0.333 . . . . 0.0 111.16 -178.246 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.59 -17.55 64.67 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 179.958 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.2 mt -111.89 12.05 20.8 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -177.091 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -66.76 133.38 50.02 Favored 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 179.932 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 40.4 t -56.89 -39.14 63.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-O 122.079 0.942 . . . . 0.0 111.326 -177.246 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -63.02 -30.24 71.44 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 113.978 -1.465 . . . . 0.0 113.381 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 2.2 m -164.53 78.62 1.43 Allowed Pre-proline 0 N--CA 1.479 0.986 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.399 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.96 147.52 61.75 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 115.732 -2.379 . . . . 0.0 112.339 177.862 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -137.3 99.57 4.01 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.672 0.748 . . . . 0.0 110.118 -179.386 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.22 -47.26 84.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.355 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.94 -32.62 67.97 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 121.99 0.9 . . . . 0.0 109.989 -176.74 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -69.52 -41.37 76.09 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.268 -1.333 . . . . 0.0 108.933 -176.543 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.405 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.57 -49.81 67.48 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 176.096 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 81.2 mt -56.45 -43.07 79.16 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.286 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.35 -38.27 90.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.64 0.733 . . . . 0.0 112.07 -179.931 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -72.1 -44.81 62.64 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.722 -0.612 . . . . 0.0 109.642 178.449 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.405 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.59 -48.09 72.55 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.542 177.205 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -62.55 -35.76 80.48 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -176.17 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -67.84 -48.97 64.69 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.395 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.66 -33.63 64.25 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.88 -179.526 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.71 -17.77 69.49 Favored Glycine 0 C--O 1.236 0.276 0 N-CA-C 115.165 0.826 . . . . 0.0 115.165 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.9 t -111.08 -12.77 14.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.064 0.932 . . . . 0.0 110.484 -179.584 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 506' ' ' LEU . . . . . 0.427 ' HB3' HG13 ' A' ' 471' ' ' VAL . 5.2 mt -67.71 148.15 51.69 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.979 -0.451 . . . . 0.0 110.462 -179.884 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.417 ' O ' HD13 ' A' ' 512' ' ' ILE . 37.4 tt0 -78.59 84.46 4.71 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-O 122.841 1.305 . . . . 0.0 109.078 177.655 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.876 HG21 HD22 ' A' ' 546' ' ' LEU . 30.3 m -99.97 48.37 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 CA-C-O 123.087 1.422 . . . . 0.0 108.477 -177.875 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.4 t -67.06 172.45 4.55 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 -179.602 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 24.1 m -49.23 -32.19 10.14 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -174.419 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -54.48 -44.95 73.08 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 178.169 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.417 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -88.68 -42.6 14.79 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 CA-C-O 121.261 0.553 . . . . 0.0 109.656 179.388 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.523 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.85 -40.07 83.16 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 -175.196 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -70.53 -28.95 65.33 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.192 -176.875 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -90.54 -4.25 57.03 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 122.364 -0.21 . . . . 0.0 111.171 177.23 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -128.24 43.02 3.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.674 0.75 . . . . 0.0 112.361 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.7 p -63.44 -24.34 67.79 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -178.833 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.64 -30.61 71.34 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.527 0.679 . . . . 0.0 112.158 178.077 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.622 HG21 HD21 ' A' ' 475' ' ' LEU . 42.7 t -71.18 -41.55 75.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 107.262 -1.385 . . . . 0.0 107.262 178.402 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 38.1 t -62.99 -37.67 79.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.616 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.08 -34.52 78.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.447 177.7 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.7 m -77.1 -39.76 48.39 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.668 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.54 HD23 HD11 ' A' ' 526' ' ' ILE . 47.0 mt -58.36 -35.52 72.08 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.261 0.553 . . . . 0.0 110.933 178.87 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.56 -29.08 70.1 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.998 -0.439 . . . . 0.0 111.343 175.246 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -72.91 -45.33 58.73 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 117.839 0.29 . . . . 0.0 111.472 178.391 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.54 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -77.66 -21.68 13.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -176.215 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.424 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.2 OUTLIER -61.19 -18.32 57.65 Favored 'General case' 0 C--O 1.211 -0.958 0 O-C-N 122.132 -0.355 . . . . 0.0 111.895 176.452 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -118.74 19.45 13.16 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.025 0.53 . . . . 0.0 112.042 176.537 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.405 ' CE2' ' HB3' ' A' ' 531' ' ' ALA . 11.2 t80 -60.96 118.18 6.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.236 0.541 . . . . 0.0 112.24 -177.263 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -74.04 -33.18 63.64 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 -176.672 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.405 ' HB3' ' CE2' ' A' ' 529' ' ' TYR . . . -67.01 -41.9 85.86 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -172.975 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -131.91 117.2 18.16 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 122.314 -0.241 . . . . 0.0 110.867 -177.811 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.4 tptt -57.7 -46.63 84.08 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.517 178.165 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -55.64 -42.66 75.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -176.383 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 72.2 t -56.73 -44.47 81.6 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.521 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 177.242 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.9 ttp -64.29 -43.86 93.45 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 119.151 -0.452 . . . . 0.0 110.036 179.435 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -64.7 -47.32 78.78 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.377 -0.529 . . . . 0.0 112.092 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -69.65 -39.14 77.25 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 119.148 -1.021 . . . . 0.0 111.104 -179.138 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.1 -39.92 83.71 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.414 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.88 -49.54 70.08 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.922 -1.036 . . . . 0.0 113.18 179.081 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -42.6 91.25 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.983 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.8 t -70.6 -50.09 47.42 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.464 -177.93 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -55.35 -45.11 76.46 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -177.999 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.6 m -66.75 -34.77 78.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.399 0.618 . . . . 0.0 111.186 179.55 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 12.3 mtt85 -60.71 -29.77 69.54 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.864 -0.522 . . . . 0.0 109.967 175.027 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.876 HD22 HG21 ' A' ' 508' ' ' VAL . 8.8 mt -76.52 -35.3 58.39 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -176.134 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.81 -28.93 70.34 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.03 178.902 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 22.1 m . . . . . 0 C--N 1.317 -0.835 0 CA-C-N 114.718 -1.128 . . . . 0.0 111.905 178.385 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.5 m . . . . . 0 C--O 1.225 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 111.263 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 56.7 t -57.37 -46.41 85.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.022 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.432 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.414 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.3 pt-20 -65.49 -34.16 77.63 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.572 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -65.24 -42.86 92.92 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 177.393 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -70.05 -34.61 73.45 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.041 -179.201 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -57.55 -40.43 78.88 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.356 -178.552 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -55.01 -40.09 69.77 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.579 -179.213 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 53.3 tttt -67.94 -57.77 5.64 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.503 -0.184 . . . . 0.0 110.503 176.744 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -45.52 89.02 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -176.126 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -60.0 -42.28 93.92 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -179.325 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 61.8 m -62.64 -39.67 94.6 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.998 -179.218 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.415 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.6 mm-40 -63.72 -37.85 88.89 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.077 178.431 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -60.08 -42.53 90.24 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.022 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.368 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -64.81 -45.12 87.6 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 122.182 -0.324 . . . . 0.0 111.568 -179.452 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -66.2 -30.44 70.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.192 -178.185 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.73 -18.19 64.81 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 178.604 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 35.2 mt -107.66 12.21 27.76 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -177.985 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -55.23 135.87 49.25 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-O 121.697 0.761 . . . . 0.0 109.914 178.124 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 13.0 m -73.49 -21.45 18.63 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.149 178.877 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.58 -31.18 47.11 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 113.798 -1.546 . . . . 0.0 111.251 -178.873 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 43.5 t -168.8 83.41 0.69 Allowed Pre-proline 0 C--O 1.238 0.483 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.912 -175.831 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.35 146.45 50.66 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 115.447 -2.569 . . . . 0.0 111.964 178.014 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -137.18 100.12 4.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.857 0.837 . . . . 0.0 111.419 -178.839 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.443 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.6 OUTLIER -58.85 -44.2 90.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.959 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -60.65 -31.82 71.02 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -177.849 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -71.53 -41.81 68.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.1 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.435 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -63.94 -48.61 75.83 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.407 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 71.4 mt -56.87 -43.88 81.66 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -176.715 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -65.35 -38.72 90.95 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.322 0.582 . . . . 0.0 111.326 -179.658 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.24 -47.13 71.7 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.425 0.631 . . . . 0.0 109.463 178.631 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.435 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.09 -42.2 80.27 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.054 178.085 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -62.8 -37.93 88.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 119.094 0.861 . . . . 0.0 112.579 -177.942 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -70.93 -44.09 66.87 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.91 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -32.92 66.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.522 0.677 . . . . 0.0 110.738 179.164 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.53 -16.97 66.13 Favored Glycine 0 C--O 1.239 0.433 0 CA-C-O 119.165 -0.797 . . . . 0.0 114.749 -179.84 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.5 t -113.74 -15.37 12.46 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.15 0.975 . . . . 0.0 111.227 -179.766 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.0 mt -64.94 145.24 56.58 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.98 -0.45 . . . . 0.0 110.813 179.734 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.426 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.3 tt0 -79.62 84.29 5.49 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 122.531 1.158 . . . . 0.0 109.653 178.168 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.954 HG21 HD22 ' A' ' 546' ' ' LEU . 27.0 m -96.44 48.18 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-O 123.214 1.483 . . . . 0.0 108.21 -178.705 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.7 t -68.16 172.99 5.06 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 -178.296 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.6 m -49.29 -31.65 9.41 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -173.643 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -55.43 -44.59 76.44 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 177.015 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.426 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -88.66 -42.18 14.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.566 0 CA-C-O 121.72 0.772 . . . . 0.0 109.1 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.424 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -57.47 -40.5 78.71 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -175.591 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -69.71 -31.3 69.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.15 -177.455 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -89.29 -5.14 57.81 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.233 178.31 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -128.94 45.03 2.86 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.43 0.633 . . . . 0.0 112.19 -179.652 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 25.2 p -65.08 -26.76 68.37 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -179.375 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -63.39 -27.25 69.17 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.918 0.866 . . . . 0.0 111.992 177.799 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 55.0 t -70.65 -45.69 72.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 179.549 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.4 -36.99 78.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 179.052 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.4 -36.36 82.08 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.861 177.42 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 61.4 m -76.26 -40.54 51.63 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 118.182 0.446 . . . . 0.0 110.457 179.445 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.717 HD23 HD11 ' A' ' 526' ' ' ILE . 61.4 mt -57.97 -35.12 70.71 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.051 0.453 . . . . 0.0 111.087 178.85 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -63.86 -29.0 70.23 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.9 -0.5 . . . . 0.0 111.452 175.733 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -73.19 -46.46 50.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.787 0.327 . . . . 0.0 111.31 178.81 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.717 HD11 HD23 ' A' ' 523' ' ' LEU . 7.7 pt -77.12 -21.18 14.4 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -175.983 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.445 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.28 -14.7 52.52 Favored 'General case' 0 C--O 1.213 -0.842 0 O-C-N 121.746 -0.596 . . . . 0.0 112.282 175.786 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -118.86 17.78 13.37 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 122.48 0.312 . . . . 0.0 111.233 175.69 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 529' ' ' TYR . . . . . 0.418 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 10.1 t80 -62.88 126.16 26.4 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.957 0.408 . . . . 0.0 110.856 -177.071 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -92.43 -24.95 18.68 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -176.437 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 531' ' ' ALA . . . . . 0.418 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -64.82 -39.81 94.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.155 0.502 . . . . 0.0 110.965 -176.963 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -133.64 121.09 21.51 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.055 -179.405 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -60.26 -44.02 95.65 Favored 'General case' 0 C--O 1.211 -0.963 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.875 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.69 -43.98 76.92 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -175.401 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.6 t -58.39 -44.65 89.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.136 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.8 ttp -64.94 -43.29 93.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.106 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.43 -48.9 75.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 179.353 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 40.2 tptt -71.66 -37.72 70.76 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 118.493 -1.283 . . . . 0.0 111.19 -177.518 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 539' ' ' ALA . . . . . 0.425 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -58.2 -40.73 82.33 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-O 121.785 0.802 . . . . 0.0 108.952 178.363 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.445 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.75 -50.81 69.6 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.219 -1.355 . . . . 0.0 113.84 178.756 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.47 -43.67 89.01 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 -179.381 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.21 -52.62 41.01 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -177.134 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -53.98 -44.05 70.48 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.598 0.359 . . . . 0.0 110.551 -177.416 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 50.8 m -64.07 -38.52 91.37 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 123.844 0.858 . . . . 0.0 111.681 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -64.41 -28.5 69.72 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 121.552 -0.717 . . . . 0.0 110.781 176.734 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.954 HD22 HG21 ' A' ' 508' ' ' VAL . 7.2 mt -74.39 -35.62 63.49 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.027 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -57.72 -39.48 77.37 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.165 177.413 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--N 1.325 -0.477 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 178.947 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 7.1 m . . . . . 0 C--O 1.221 -0.441 0 CA-C-O 120.756 0.312 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -54.79 -45.83 74.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 O-C-N 121.894 -0.504 . . . . 0.0 111.578 179.516 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.417 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.9 OUTLIER -62.48 -31.58 72.34 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.021 -178.854 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -73.5 -42.14 62.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 122.138 0.97 . . . . 0.0 108.405 179.384 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -70.33 -32.71 70.56 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.379 -177.628 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.415 ' C ' HD13 ' A' ' 475' ' ' LEU . 1.9 tm? -55.05 -40.21 70.04 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.358 178.842 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -54.23 -40.6 67.85 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.686 -178.268 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -69.54 -53.2 20.14 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.314 177.75 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -46.86 86.56 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -178.742 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -60.25 -43.67 95.91 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -179.465 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 69.0 m -60.24 -38.71 84.28 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 118.01 0.368 . . . . 0.0 111.124 -179.83 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -65.71 -36.34 83.34 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 120.159 -0.617 . . . . 0.0 110.978 177.549 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 89.1 mt -61.46 -43.12 96.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 178.696 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -62.18 -45.87 91.48 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 179.825 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -66.5 -34.23 77.45 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.747 0.308 . . . . 0.0 111.207 -178.368 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.35 -18.95 65.13 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 179.677 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.8 mt -108.2 12.15 26.86 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.573 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 8.5 mttm -56.82 131.6 49.87 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 176.869 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 14.5 m -72.7 -20.39 19.3 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.634 -179.329 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.7 -30.74 41.13 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 113.779 -1.555 . . . . 0.0 110.921 -178.951 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 25.0 t -166.27 85.8 0.92 Allowed Pre-proline 0 C--O 1.239 0.512 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.418 -177.977 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.81 149.56 48.21 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 117.314 -1.324 . . . . 0.0 112.415 178.477 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -137.29 93.39 2.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.589 0.709 . . . . 0.0 110.183 -177.246 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.417 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.8 OUTLIER -58.4 -47.34 88.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 -177.438 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 26.5 pttt -58.77 -31.4 68.34 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-O 121.696 0.76 . . . . 0.0 110.347 -176.38 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.0 ttm-85 -68.81 -43.33 75.81 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.227 -178.673 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.438 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -63.24 -48.81 76.68 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.556 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.9 mt -57.48 -42.79 83.34 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -176.762 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -65.53 -38.58 90.07 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.54 0.686 . . . . 0.0 111.495 179.163 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.69 -47.07 70.48 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.034 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.438 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.88 -45.58 82.46 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.206 178.859 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -64.75 -34.63 78.78 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -176.486 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -44.11 66.42 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 176.282 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.79 -35.6 66.47 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.28 0.562 . . . . 0.0 110.898 179.429 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.46 -18.65 69.97 Favored Glycine 0 C--O 1.239 0.448 0 N-CA-C 114.762 0.665 . . . . 0.0 114.762 -179.858 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 12.7 t -109.31 -12.4 14.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.917 0.858 . . . . 0.0 110.581 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -68.78 146.25 53.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.163 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -80.35 80.58 6.76 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-O 122.508 1.147 . . . . 0.0 109.031 178.144 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.881 HG21 HD22 ' A' ' 546' ' ' LEU . 29.3 m -94.3 48.17 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 123.071 1.415 . . . . 0.0 107.576 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.68 173.62 3.35 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.709 -177.978 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 34.3 m -48.46 -35.33 12.73 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.517 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -55.52 -44.34 76.58 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.267 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -87.62 -38.71 12.25 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.397 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -179.41 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.418 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.21 -37.74 81.2 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -176.749 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -66.27 -33.73 76.4 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.567 0.222 . . . . 0.0 111.426 -179.553 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -89.35 -3.29 58.52 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 121.076 -0.25 . . . . 0.0 111.316 179.172 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -128.12 43.42 3.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.875 0.845 . . . . 0.0 112.398 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -64.17 -28.56 69.84 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 121.722 -0.611 . . . . 0.0 112.466 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -70.53 -24.26 62.78 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.501 0.667 . . . . 0.0 112.034 179.176 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 86.7 t -70.87 -43.82 76.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 106.152 -1.796 . . . . 0.0 106.152 177.302 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 49.5 t -62.53 -35.62 70.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 178.244 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.99 -35.93 81.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 119.042 -0.504 . . . . 0.0 111.645 177.318 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.5 m -77.06 -39.17 50.87 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.165 0.893 . . . . 0.0 108.734 179.32 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.545 HD23 HD11 ' A' ' 526' ' ' ILE . 34.9 mt -57.5 -35.01 69.69 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.813 0.34 . . . . 0.0 111.664 179.019 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -63.3 -29.12 70.5 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.878 -0.513 . . . . 0.0 111.392 175.623 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -76.49 -46.24 27.6 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.657 0.265 . . . . 0.0 111.708 -179.422 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.545 HD11 HD23 ' A' ' 523' ' ' LEU . 1.1 pt -74.77 -23.57 17.78 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.932 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -176.929 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.455 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 1.7 mtm180 -59.94 -20.65 58.67 Favored 'General case' 0 C--O 1.214 -0.788 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 176.152 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -119.51 19.41 12.66 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.976 0.51 . . . . 0.0 111.48 178.854 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -62.03 117.91 6.59 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 121.063 0.458 . . . . 0.0 111.355 -177.564 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -79.49 -26.59 41.59 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -176.475 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.14 -40.93 86.84 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.692 -0.403 . . . . 0.0 112.081 -175.354 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -131.55 117.0 18.16 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -178.464 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -59.05 -43.62 91.7 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.617 179.039 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -57.79 -42.24 83.76 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.062 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -57.53 -43.12 82.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 O-C-N 121.809 -0.557 . . . . 0.0 109.542 177.454 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -43.03 94.36 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 178.559 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -63.87 -49.28 73.39 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.121 0.263 . . . . 0.0 110.476 -178.336 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -70.88 -40.63 72.13 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.958 -178.222 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.14 -38.77 80.47 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.14 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.455 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.79 -50.17 70.05 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 177.757 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.68 -42.15 83.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 77.0 t -70.44 -52.06 32.59 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.859 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.135 -178.618 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -54.48 -44.47 72.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.641 0.258 . . . . 0.0 110.412 -177.171 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 24.8 m -65.25 -38.43 90.33 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 122.909 0.483 . . . . 0.0 111.022 179.358 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 44.1 mtt180 -59.99 -30.71 69.31 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 121.838 -0.539 . . . . 0.0 110.752 176.573 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.881 HD22 HG21 ' A' ' 508' ' ' VAL . 3.8 mt -76.24 -30.88 58.08 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 -176.782 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.11 -37.95 89.23 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.899 177.575 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.7 m . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 177.982 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 C--O 1.222 -0.389 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 22.4 t -53.0 -47.04 54.47 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.122 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 178.841 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.424 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.1 OUTLIER -63.74 -34.19 77.33 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.585 -177.252 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -68.76 -40.5 79.71 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 122.464 1.126 . . . . 0.0 108.526 179.42 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -73.34 -34.86 65.88 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.1 -177.731 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.571 HD21 HG21 ' A' ' 519' ' ' VAL . 4.5 tt -58.42 -36.14 73.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.054 179.408 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -54.18 -43.13 70.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 118.456 0.571 . . . . 0.0 109.862 178.325 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -67.82 -56.32 9.6 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.556 178.372 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -44.99 81.16 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.333 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 479' ' ' HIS . . . . . 0.441 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.4 t-160 -58.52 -43.56 89.21 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 179.166 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.5 m -64.74 -37.85 88.99 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 179.495 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.465 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.8 mm-40 -63.38 -38.14 90.01 Favored 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.05 178.307 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.11 -44.25 87.03 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.535 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.4 mmtt -62.52 -46.3 89.04 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -179.514 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -64.6 -33.59 76.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.871 0.367 . . . . 0.0 111.159 -178.243 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.84 -18.21 65.18 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 179.371 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 486' ' ' LEU . . . . . 0.409 HD11 ' CG2' ' A' ' 526' ' ' ILE . 26.1 mt -108.07 12.15 27.08 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.112 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -56.12 127.81 32.43 Favored 'General case' 0 CA--C 1.493 -1.219 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 176.527 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 29.6 m -70.25 -20.48 22.87 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.211 178.536 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -80.97 -27.41 36.0 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.155 -1.384 . . . . 0.0 111.091 177.864 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 4.2 m -160.81 75.62 2.63 Favored Pre-proline 0 N--CA 1.473 0.676 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.612 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -74.35 143.35 31.31 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 113.523 -3.851 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -137.25 98.19 3.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.788 0.804 . . . . 0.0 109.734 -178.65 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.44 -45.51 93.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.509 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -59.55 -31.05 69.06 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 -178.362 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -70.37 -41.29 73.3 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.762 -0.775 . . . . 0.0 108.96 -178.1 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.48 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.03 -48.35 76.66 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 175.889 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 96.7 mt -57.27 -43.18 82.87 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -176.719 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -64.58 -39.03 93.0 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.532 0.682 . . . . 0.0 111.3 178.677 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -65.74 -48.5 71.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.648 0.737 . . . . 0.0 109.695 178.599 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.48 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -57.86 -48.27 80.3 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.997 178.641 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -62.94 -33.07 74.57 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 119.847 -0.741 . . . . 0.0 112.803 -175.631 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.35 -48.65 40.18 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.44 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -30.67 42.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.801 0.81 . . . . 0.0 110.155 -178.849 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -63.85 -23.6 67.57 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 115.846 1.098 . . . . 0.0 115.846 176.821 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 9.0 t -104.88 -26.48 12.2 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 117.883 0.841 . . . . 0.0 110.367 178.766 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.2 mp -57.0 140.5 48.82 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 176.058 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -76.99 84.41 3.51 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 122.339 1.066 . . . . 0.0 110.692 -178.914 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.585 ' CG2' HD22 ' A' ' 546' ' ' LEU . 16.6 m -103.42 68.95 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 CA-C-O 126.794 3.188 . . . . 0.0 105.489 178.039 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.0 t -80.41 173.73 12.31 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 109.892 -3.322 . . . . 0.0 105.204 172.636 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.2 m -49.36 -36.73 22.4 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -175.365 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -54.29 -43.77 71.35 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -179.017 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.0 mp -88.56 -38.98 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.801 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 -178.03 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 4.8 mt -61.61 -39.4 91.12 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -175.886 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -68.82 -31.0 69.67 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.193 -0.203 . . . . 0.0 110.644 -177.861 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -87.27 -7.04 58.28 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 121.122 -0.231 . . . . 0.0 111.073 176.781 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -129.6 45.77 2.75 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.545 0.688 . . . . 0.0 112.11 179.194 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -63.89 -25.95 68.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.877 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.07 -29.03 69.3 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.846 0.831 . . . . 0.0 112.337 178.556 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 519' ' ' VAL . . . . . 0.571 HG21 HD21 ' A' ' 475' ' ' LEU . 65.0 t -71.08 -45.01 74.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 178.553 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 57.2 t -61.0 -38.1 78.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.149 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.25 -38.95 92.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.88 177.612 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 95.3 m -71.94 -38.69 69.79 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 118.371 0.532 . . . . 0.0 109.961 -178.613 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.634 HD23 HD11 ' A' ' 526' ' ' ILE . 63.3 mt -58.63 -34.89 71.69 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.116 0.484 . . . . 0.0 111.461 179.422 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -67.26 -29.13 68.67 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 121.613 -0.679 . . . . 0.0 111.012 176.27 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -71.52 -42.1 68.37 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.725 0.298 . . . . 0.0 111.151 179.861 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.634 HD11 HD23 ' A' ' 523' ' ' LEU . 6.0 pt -78.65 -23.28 13.12 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.266 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.539 ' HD2' ' HA ' ' A' ' 540' ' ' ALA . 7.4 mtp180 -64.69 -13.31 53.84 Favored 'General case' 0 C--O 1.217 -0.638 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 175.655 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.89 18.47 13.25 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.947 0.499 . . . . 0.0 111.544 175.07 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -66.47 118.07 9.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 112.044 -177.677 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -81.81 -26.64 34.18 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -177.573 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.54 -29.87 68.54 Favored 'General case' 0 C--O 1.219 -0.512 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -175.151 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -144.69 118.88 9.48 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.415 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -61.76 -46.58 88.95 Favored 'General case' 0 C--O 1.213 -0.86 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.452 -178.626 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -56.04 -38.96 71.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.17 0.509 . . . . 0.0 112.109 -175.175 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.8 t -55.96 -45.31 80.07 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 O-C-N 122.076 -0.39 . . . . 0.0 110.111 177.539 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -68.06 -40.78 82.69 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.754 178.432 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.09 -47.98 80.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 119.303 0.956 . . . . 0.0 111.567 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.7 tptt -72.18 -37.91 69.21 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 119.076 -1.049 . . . . 0.0 111.378 -178.741 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 539' ' ' ALA . . . . . 0.412 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -59.08 -38.06 78.56 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.254 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.539 ' HA ' ' HD2' ' A' ' 527' ' ' ARG . . . -66.63 -49.97 64.52 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.358 179.275 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -42.48 83.59 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.886 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 75.3 t -70.59 -53.45 22.37 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.262 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.965 -177.887 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 69.9 t80 -53.81 -46.97 71.26 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.184 0.516 . . . . 0.0 110.312 -176.011 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 27.8 m -60.07 -38.15 82.01 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.38 0.672 . . . . 0.0 112.343 178.286 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -65.21 -27.41 68.66 Favored 'General case' 0 C--N 1.32 -0.709 0 O-C-N 121.419 -0.801 . . . . 0.0 111.785 176.749 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.585 HD22 ' CG2' ' A' ' 508' ' ' VAL . 9.7 mt -75.59 -35.77 60.49 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -174.651 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -33.95 73.55 Favored 'General case' 0 C--O 1.205 -1.273 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.67 176.704 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 45.3 t . . . . . 0 C--N 1.319 -0.72 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.315 175.019 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.1 m . . . . . 0 C--O 1.224 -0.271 0 CA-C-O 121.109 0.481 . . . . 0.0 112.073 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.6 t -54.21 -44.19 63.64 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.38 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -66.92 -33.18 75.02 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 120.762 0.315 . . . . 0.0 111.721 -178.274 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.18 -39.98 82.38 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.675 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -73.72 -32.18 63.76 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.935 -177.242 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.426 HD23 HD21 ' A' ' 503' ' ' LEU . 1.6 tm? -54.58 -38.96 67.33 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.253 178.833 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -53.18 -38.71 63.06 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 121.321 -0.151 . . . . 0.0 111.264 -178.693 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -67.83 -57.67 5.89 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.568 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.88 -46.22 90.0 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -174.526 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -58.92 -43.16 91.08 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -179.501 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 67.0 m -63.28 -40.4 97.28 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 117.869 0.304 . . . . 0.0 111.213 -178.935 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.466 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.9 mm-40 -63.57 -37.52 87.65 Favored 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 120.671 -0.411 . . . . 0.0 111.149 178.862 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 94.3 mt -59.9 -44.06 93.52 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.989 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.168 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 49.2 mmtt -62.67 -44.67 95.66 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 122.153 -0.342 . . . . 0.0 111.919 -179.746 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -65.13 -33.88 77.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.781 0.324 . . . . 0.0 111.073 -178.189 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.89 -16.55 64.39 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 179.249 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 38.4 mt -111.08 12.24 21.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.868 -177.459 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -55.44 129.4 38.56 Favored 'General case' 0 C--O 1.21 -1.011 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 176.665 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.9 t -62.62 -39.75 85.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 122.16 0.981 . . . . 0.0 108.446 178.507 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.12 -28.07 64.04 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.066 -1.425 . . . . 0.0 113.414 -178.021 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.1 t -159.48 76.38 3.06 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -177.593 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -75.33 146.6 31.68 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 117.495 -1.203 . . . . 0.0 113.812 179.516 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -137.37 101.64 4.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.31 0.576 . . . . 0.0 111.397 178.575 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 493' ' ' VAL . . . . . 0.447 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.3 OUTLIER -56.58 -46.17 82.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -179.429 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 15.0 pttt -58.77 -32.2 69.06 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 121.857 0.837 . . . . 0.0 109.791 -176.478 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -70.83 -40.48 72.41 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.391 -1.277 . . . . 0.0 108.888 -176.476 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.437 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.51 -49.7 68.02 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 175.624 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.6 mt -56.91 -43.1 81.04 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.256 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -66.01 -37.08 84.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.467 0.651 . . . . 0.0 111.625 179.997 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.466 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.84 -47.71 68.21 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.772 0.796 . . . . 0.0 109.316 177.702 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.437 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.71 -44.97 82.07 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.77 178.632 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -60.57 -36.8 79.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 119.036 0.835 . . . . 0.0 112.673 -177.165 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -73.77 -42.64 60.74 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 178.69 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.426 HD21 HD23 ' A' ' 475' ' ' LEU . 0.5 OUTLIER -58.91 -34.29 71.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.164 0.507 . . . . 0.0 110.637 -179.436 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.1 -17.67 66.0 Favored Glycine 0 C--O 1.241 0.565 0 N-CA-C 114.848 0.699 . . . . 0.0 114.848 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.8 t -110.69 -14.7 13.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 117.699 0.75 . . . . 0.0 110.587 -179.131 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.2 mt -67.44 145.86 54.58 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.489 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.456 ' O ' HD13 ' A' ' 512' ' ' ILE . 30.3 tt0 -79.16 84.3 5.14 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 122.53 1.157 . . . . 0.0 109.797 178.37 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.947 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -96.8 48.5 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 CA-C-O 123.351 1.548 . . . . 0.0 108.126 -178.966 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.5 t -67.26 174.43 3.25 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 -179.436 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 13.1 m -49.23 -34.75 15.65 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -173.361 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -53.7 -44.06 69.47 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.73 0.271 . . . . 0.0 111.73 178.187 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.456 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.5 mp -88.48 -40.69 13.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.53 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.451 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.82 -38.04 80.89 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -175.644 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -66.99 -32.61 73.96 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.559 -179.002 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -90.23 -4.3 57.29 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.347 -0.221 . . . . 0.0 111.088 178.813 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -128.58 45.91 2.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.777 0.799 . . . . 0.0 112.484 -179.355 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 29.0 p -66.06 -26.91 67.71 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.426 -0.796 . . . . 0.0 112.399 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.4 -28.26 66.93 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.596 1.189 . . . . 0.0 112.465 178.383 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 91.4 t -68.69 -44.78 82.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 178.968 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.79 -37.5 79.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 178.354 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.42 -34.32 76.54 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.046 177.806 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.8 m -78.53 -39.47 37.85 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 118.48 0.582 . . . . 0.0 109.676 -179.801 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.55 HD23 HD11 ' A' ' 526' ' ' ILE . 44.0 mt -57.7 -34.92 69.96 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.962 0.41 . . . . 0.0 111.407 178.591 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -63.73 -29.13 70.39 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.879 -0.513 . . . . 0.0 111.629 175.232 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -74.02 -42.59 60.1 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 122.098 -0.376 . . . . 0.0 111.977 -179.741 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.55 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.83 -21.64 12.88 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -178.406 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 527' ' ' ARG . . . . . 0.417 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -65.02 -11.21 36.52 Favored 'General case' 0 C--O 1.214 -0.78 0 O-C-N 121.97 -0.456 . . . . 0.0 112.097 175.554 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 41.0 ptt85 -122.13 19.44 10.74 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 122.998 0.519 . . . . 0.0 111.596 175.334 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -65.48 120.46 12.9 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -175.606 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -85.98 -27.92 24.56 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -177.434 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.86 -41.45 95.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.245 0.545 . . . . 0.0 111.616 -175.289 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -132.35 112.5 12.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.948 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -62.62 -33.57 75.28 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.272 -179.314 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -58.17 -41.98 85.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.521 0.676 . . . . 0.0 111.34 -179.969 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 94.3 t -60.27 -41.02 85.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 O-C-N 121.876 -0.515 . . . . 0.0 109.618 178.238 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 38.1 ttm -57.8 -47.38 82.73 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 120.814 0.34 . . . . 0.0 110.122 179.073 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.24 -48.38 73.51 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.035 -179.458 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -72.03 -37.81 69.68 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 118.627 -1.229 . . . . 0.0 111.147 -175.399 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.94 -38.66 83.06 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.01 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 540' ' ' ALA . . . . . 0.417 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -66.83 -48.97 67.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.861 -1.063 . . . . 0.0 113.709 179.425 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -41.83 88.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -179.705 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 63.3 t -70.6 -51.03 40.52 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.593 -178.689 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -55.08 -44.74 75.11 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.597 0.237 . . . . 0.0 110.486 -177.554 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 20.7 m -67.07 -35.55 80.08 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 123.019 0.528 . . . . 0.0 110.727 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 16.0 mtt85 -60.58 -29.3 69.1 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 121.807 -0.558 . . . . 0.0 110.157 175.606 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.947 HD22 HG21 ' A' ' 508' ' ' VAL . 9.4 mt -76.2 -34.44 59.28 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 -175.603 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -31.5 70.85 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.061 178.205 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.6 m . . . . . 0 C--N 1.319 -0.73 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 176.908 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.5 m . . . . . 0 C--O 1.224 -0.268 0 CA-C-O 120.939 0.4 . . . . 0.0 111.274 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 49.9 t -54.38 -45.19 69.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.064 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 179.652 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 472' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -64.74 -34.13 77.59 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.796 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -68.0 -41.29 82.47 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 178.604 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -72.35 -32.61 66.63 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.219 -177.84 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 475' ' ' LEU . . . . . 0.421 HD23 HD21 ' A' ' 503' ' ' LEU . 1.6 tm? -56.61 -38.85 72.63 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.186 178.846 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -53.42 -40.45 65.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 118.345 0.52 . . . . 0.0 110.654 -179.065 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 56.8 tttt -67.36 -56.68 8.7 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 176.856 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -45.91 89.89 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -176.119 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -60.37 -43.32 96.67 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -179.739 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 67.4 m -62.17 -40.47 96.13 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.644 -178.574 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 481' ' ' GLU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.7 mm-40 -63.01 -38.72 92.33 Favored 'General case' 0 CA--C 1.508 -0.662 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.402 178.61 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -60.23 -43.57 93.64 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 179.472 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.41 -41.95 93.06 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.524 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -65.73 -34.33 77.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.801 0.334 . . . . 0.0 110.875 179.623 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.35 -17.13 64.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 179.398 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 486' ' ' LEU . . . . . 0.427 HD11 ' CG2' ' A' ' 526' ' ' ILE . 25.8 mt -108.59 12.14 26.17 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -178.614 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 6.0 mtpt -54.88 130.97 43.25 Favored 'General case' 0 C--O 1.209 -1.068 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 177.729 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.0 t -63.75 -41.17 91.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 122.468 1.127 . . . . 0.0 108.129 177.507 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -28.95 68.23 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 113.465 -1.698 . . . . 0.0 113.632 -179.337 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.3 t -159.75 76.08 2.99 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.799 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -75.56 144.5 28.53 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 116.6 -1.8 . . . . 0.0 113.535 179.407 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -137.08 104.27 5.38 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.277 0.561 . . . . 0.0 111.099 179.477 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.04 -46.09 94.69 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.934 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -57.02 -32.67 66.39 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 120.96 0.41 . . . . 0.0 109.931 -177.998 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -70.12 -40.29 74.94 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -176.234 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 496' ' ' CYS . . . . . 0.429 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.95 -49.04 71.91 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 176.007 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 74.9 mt -57.31 -44.1 83.85 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -175.998 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.62 -40.15 96.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.76 0.791 . . . . 0.0 110.336 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 499' ' ' ALA . . . . . 0.418 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -68.91 -46.92 67.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.361 0.6 . . . . 0.0 110.49 179.39 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 500' ' ' LEU . . . . . 0.429 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -55.88 -48.64 75.22 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.477 179.139 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -63.02 -35.62 80.83 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -175.483 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -69.98 -43.27 71.81 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 176.707 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 503' ' ' LEU . . . . . 0.421 HD21 HD23 ' A' ' 475' ' ' LEU . 1.5 tm? -59.29 -34.74 72.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.343 0.592 . . . . 0.0 110.336 -179.338 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.17 -17.98 62.09 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-O 119.207 -0.774 . . . . 0.0 114.745 179.78 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.3 t -112.95 -7.7 13.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.149 0.975 . . . . 0.0 111.064 -179.449 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.5 mt -72.72 148.57 44.55 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.523 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 507' ' ' GLN . . . . . 0.454 ' O ' HD13 ' A' ' 512' ' ' ILE . 34.4 tt0 -78.57 84.58 4.68 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 122.807 1.289 . . . . 0.0 109.985 178.388 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 508' ' ' VAL . . . . . 0.926 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -97.07 46.83 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.325 0 CA-C-O 122.748 1.261 . . . . 0.0 108.939 -178.181 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.0 t -67.28 172.43 4.81 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -178.244 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 15.7 m -49.36 -32.15 10.78 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -173.949 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.36 -45.3 76.52 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 122.348 -0.22 . . . . 0.0 111.528 177.799 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 512' ' ' ILE . . . . . 0.454 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.5 mp -86.86 -42.39 15.43 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.818 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 513' ' ' LEU . . . . . 0.444 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.08 -40.13 80.3 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -175.715 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -69.55 -29.43 67.01 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.354 -177.654 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -90.53 -3.34 57.67 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 122.338 -0.227 . . . . 0.0 110.979 177.537 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -128.76 45.3 2.81 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.71 0.767 . . . . 0.0 112.388 179.382 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 22.3 p -64.66 -27.35 68.86 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.881 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.39 -24.59 65.7 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 122.1 0.952 . . . . 0.0 112.207 178.167 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.5 t -71.74 -45.98 63.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 178.363 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.82 -35.54 71.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.846 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -58.21 -46.1 86.46 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 176.46 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.7 m -71.2 -39.15 71.97 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.641 -175.331 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 523' ' ' LEU . . . . . 0.668 HD23 HD11 ' A' ' 526' ' ' ILE . 72.7 mt -57.61 -35.47 70.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.884 0.373 . . . . 0.0 111.186 179.044 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -66.06 -29.12 69.41 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 121.789 -0.569 . . . . 0.0 112.382 176.912 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.92 -53.11 10.84 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.826 0.822 . . . . 0.0 110.419 179.633 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 526' ' ' ILE . . . . . 0.668 HD11 HD23 ' A' ' 523' ' ' LEU . 22.6 pt -65.47 -24.64 35.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -179.419 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.28 -16.92 61.79 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 176.004 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.73 19.2 13.24 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.791 0.437 . . . . 0.0 111.111 177.072 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -65.72 120.86 13.75 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 123.201 0.6 . . . . 0.0 111.462 -179.027 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -91.5 -19.42 22.82 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -178.126 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -69.49 -22.81 63.58 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.129 -177.754 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.68 128.98 12.0 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.749 174.774 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -64.28 -49.5 71.59 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.222 -178.454 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -58.17 -38.36 76.49 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.251 0.548 . . . . 0.0 111.808 -173.839 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.95 -44.9 79.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 176.873 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.6 ttp -68.32 -43.26 77.97 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 119.256 -0.402 . . . . 0.0 110.362 179.431 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -64.36 -47.78 78.03 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.406 -0.518 . . . . 0.0 112.354 -179.411 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -69.82 -38.09 76.46 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.42 -178.3 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.2 -40.73 86.7 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-O 121.619 0.723 . . . . 0.0 109.287 178.133 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.61 73.87 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.524 -1.217 . . . . 0.0 112.638 -179.923 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -42.48 90.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.454 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.2 t -70.5 -51.11 40.34 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.994 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.414 -178.317 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -54.49 -45.09 73.15 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -177.781 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.9 m -66.19 -35.11 79.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.297 0.57 . . . . 0.0 111.262 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 23.1 mtt85 -61.65 -30.07 70.48 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.783 -0.573 . . . . 0.0 109.947 174.933 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 546' ' ' LEU . . . . . 0.926 HD22 HG21 ' A' ' 508' ' ' VAL . 8.5 mt -76.68 -34.05 58.22 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -175.754 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -28.14 68.85 Favored 'General case' 0 C--O 1.217 -0.639 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.67 178.212 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.9 m . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 114.92 -1.037 . . . . 0.0 111.991 177.769 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -71.72 155.37 40.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 177.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 80.1 p -153.96 154.87 30.61 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 105.384 -2.08 . . . . 0.0 105.384 178.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -67.93 149.61 77.74 Favored 'Trans proline' 0 C--O 1.245 0.836 0 C-N-CA 116.627 -1.782 . . . . 0.0 113.189 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.2 m -69.52 167.0 17.69 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.615 -179.653 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.414 HG13 ' HB3' ' A' ' 506' ' ' LEU . 53.7 t -56.18 -47.78 80.24 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.907 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.751 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -63.44 -34.18 77.18 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -67.16 -42.74 83.83 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 177.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 17.5 mttt -69.43 -35.48 75.72 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 121.727 0.775 . . . . 0.0 109.997 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.437 HD21 HG21 ' A' ' 519' ' ' VAL . 1.5 tm? -57.13 -37.42 71.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.879 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -54.46 -40.68 68.63 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.405 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -72.36 -54.06 10.52 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.131 177.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.47 -46.75 73.43 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 -177.258 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.4 t-160 -61.33 -41.06 96.39 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 52.5 m -64.06 -40.57 96.56 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.97 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 72.3 mm-40 -63.72 -43.09 97.59 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-N 118.153 0.433 . . . . 0.0 110.652 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.02 -46.89 66.02 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.19 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 177.568 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -67.01 -39.5 87.11 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -177.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -68.57 -28.07 66.63 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 122.157 -0.339 . . . . 0.0 110.755 177.855 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.69 -18.42 62.82 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.6 mt -105.99 12.08 30.89 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.874 -177.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 52.4 mttt -54.09 127.29 26.03 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.6 t -62.26 -42.11 94.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.932 0.872 . . . . 0.0 109.678 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.33 -30.66 69.68 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.205 -1.362 . . . . 0.0 112.943 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 14.2 t -155.31 75.9 5.17 Favored Pre-proline 0 C--O 1.244 0.769 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -175.053 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -74.95 146.65 33.13 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 117.394 -1.271 . . . . 0.0 112.72 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -137.28 100.76 4.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.331 0.586 . . . . 0.0 109.762 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.72 -46.13 96.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -58.09 -31.12 66.81 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.064 0.227 . . . . 0.0 110.447 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -69.28 -41.11 77.28 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.441 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.69 -49.04 69.99 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.498 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 83.4 mt -56.85 -44.18 81.91 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.07 -41.07 97.77 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.6 0.714 . . . . 0.0 110.824 179.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.445 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.93 -47.3 69.07 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.286 0.565 . . . . 0.0 109.767 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.441 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.29 -46.32 79.82 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.186 177.641 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -64.66 -35.36 80.79 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 119.032 0.833 . . . . 0.0 113.123 -176.171 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -68.88 -46.61 67.95 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 176.462 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.427 HD21 HD23 ' A' ' 475' ' ' LEU . 0.9 OUTLIER -57.69 -33.23 68.15 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.427 0.632 . . . . 0.0 110.547 -179.417 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.76 -19.21 67.09 Favored Glycine 0 C--O 1.238 0.345 0 CA-C-O 119.312 -0.716 . . . . 0.0 114.543 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.7 t -109.98 -13.75 14.36 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.91 0.855 . . . . 0.0 110.237 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.414 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.0 mt -67.3 145.91 54.65 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.964 -0.46 . . . . 0.0 110.344 179.382 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.426 ' O ' HD13 ' A' ' 512' ' ' ILE . 28.7 tt0 -79.37 84.45 5.28 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-O 122.79 1.281 . . . . 0.0 109.809 178.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.916 HG21 HD22 ' A' ' 546' ' ' LEU . 27.8 m -95.69 46.49 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 CA-C-O 122.9 1.333 . . . . 0.0 108.433 -179.055 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.4 t -66.67 171.78 4.84 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 -177.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.1 m -49.26 -30.9 7.89 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -174.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -56.09 -46.58 78.99 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 175.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.426 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -86.72 -41.77 15.08 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.455 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.438 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -57.51 -39.69 77.05 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.84 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -68.12 -31.21 70.64 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.392 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -90.38 -4.44 57.06 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 122.172 -0.33 . . . . 0.0 111.331 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 88.7 m-20 -127.94 41.11 3.56 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.276 0.56 . . . . 0.0 111.458 -179.291 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.2 p -63.64 -27.93 69.56 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 121.604 -0.685 . . . . 0.0 112.776 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.13 -26.41 68.18 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.617 0.722 . . . . 0.0 111.842 177.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.437 HG21 HD21 ' A' ' 475' ' ' LEU . 47.6 t -71.93 -43.15 68.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 44.9 t -62.71 -35.23 69.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 178.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.09 85.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 119.228 -0.415 . . . . 0.0 111.368 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.0 m -78.14 -37.91 44.96 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 118.991 0.814 . . . . 0.0 109.719 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.568 HD23 HD11 ' A' ' 526' ' ' ILE . 39.5 mt -57.97 -35.0 70.56 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.076 0.465 . . . . 0.0 111.178 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -64.56 -29.08 70.11 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.803 -0.561 . . . . 0.0 111.536 175.102 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -74.31 -41.62 60.83 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.568 HD11 HD23 ' A' ' 523' ' ' LEU . 1.2 pt -78.74 -23.14 13.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.103 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.214 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -13.07 32.64 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 176.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.7 ptt180 -119.14 16.35 13.23 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 122.822 0.449 . . . . 0.0 110.841 176.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -64.66 121.82 15.38 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.059 0.457 . . . . 0.0 112.103 -175.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -92.29 -25.62 18.5 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -177.375 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.02 -25.51 65.43 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.637 -177.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.86 121.22 9.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.915 0.388 . . . . 0.0 110.371 174.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -39.99 94.98 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.91 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -60.68 -40.95 94.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.614 0.721 . . . . 0.0 111.745 -176.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 59.4 t -56.01 -43.39 75.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.957 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.7 ttp -66.27 -40.73 90.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 122.066 0.146 . . . . 0.0 110.621 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.42 -48.41 70.12 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -69.7 -38.26 76.9 Favored 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 118.977 -1.089 . . . . 0.0 110.244 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.63 -39.87 81.75 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.2 -48.37 68.09 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -40.79 90.53 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 62.1 t -70.63 -53.1 23.73 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.3 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 543' ' ' TYR . . . . . 0.529 ' CE1' ' HD3' ' A' ' 547' ' ' LYS . 51.6 t80 -55.0 -41.74 71.65 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.181 0.515 . . . . 0.0 110.901 -177.213 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 544' ' ' THR . . . . . 0.466 ' HA ' ' HE3' ' A' ' 547' ' ' LYS . 30.0 m -65.27 -38.55 90.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.141 0.496 . . . . 0.0 111.197 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 -64.74 -27.05 68.64 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.177 177.015 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.916 HD22 HG21 ' A' ' 508' ' ' VAL . 11.9 mt -73.94 -37.8 64.45 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -176.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 547' ' ' LYS . . . . . 0.529 ' HD3' ' CE1' ' A' ' 543' ' ' TYR . 5.2 mtmp? -63.76 -24.73 67.88 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.273 178.114 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.8 m -81.67 -8.55 59.72 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.127 178.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 73.7 mtt85 -113.42 -15.79 12.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 122.512 0.325 . . . . 0.0 111.8 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -94.11 -158.74 33.74 Favored Glycine 0 N--CA 1.453 -0.226 0 CA-C-N 116.166 -0.47 . . . . 0.0 112.936 -176.62 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--O 1.256 1.402 0 N-CA-C 104.335 -2.469 . . . . 0.0 104.335 178.633 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.705 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -68.65 151.81 46.21 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 174.068 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 19.2 m 47.08 59.49 16.33 Favored Pre-proline 0 N--CA 1.477 0.877 0 O-C-N 123.675 0.609 . . . . 0.0 111.938 -175.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -71.78 152.79 58.82 Favored 'Trans proline' 0 C--N 1.348 0.552 0 N-CA-C 115.884 1.455 . . . . 0.0 115.884 -174.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.1 m -70.89 166.7 20.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.745 178.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.422 HG13 ' HB3' ' A' ' 506' ' ' LEU . 48.6 t -53.75 -49.25 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -179.432 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.429 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.8 pt-20 -65.92 -32.28 73.69 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.693 -178.831 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -67.47 -40.71 85.31 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 12.7 mtpt -72.32 -32.99 67.03 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.499 -176.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.7 -40.11 71.93 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.548 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -53.23 -39.85 64.11 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 121.245 -0.182 . . . . 0.0 110.895 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -71.97 -55.24 7.79 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.265 176.291 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -47.06 78.43 Favored 'General case' 0 C--O 1.218 -0.563 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -175.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -61.47 -39.88 92.49 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 59.1 m -64.92 -41.25 95.72 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.587 179.253 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.456 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.9 mm-40 -63.19 -43.17 98.94 Favored 'General case' 0 CA--C 1.506 -0.718 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.805 178.762 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.14 -47.62 66.76 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -67.36 -37.68 83.58 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -176.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -67.73 -31.64 71.71 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.55 -19.09 65.24 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 23.8 mt -103.06 12.19 36.27 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 38.6 mttt -55.57 128.52 34.93 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 72.2 t -61.43 -43.12 96.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.816 0.817 . . . . 0.0 109.66 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -74.23 -19.84 60.38 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.469 -1.242 . . . . 0.0 113.456 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 7.3 m -156.39 69.0 4.79 Favored Pre-proline 0 N--CA 1.47 0.574 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -176.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.58 145.11 29.16 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 114.267 -3.355 . . . . 0.0 112.573 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -137.33 96.76 3.33 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.892 0.853 . . . . 0.0 109.867 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.409 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.6 OUTLIER -56.32 -46.43 81.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -178.931 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.35 -30.67 69.69 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -69.73 -40.43 76.22 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 -178.037 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.456 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.97 -49.1 71.61 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.814 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 87.5 mt -56.64 -43.06 79.89 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -64.39 -38.54 91.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.387 0.613 . . . . 0.0 111.425 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.456 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.03 -48.53 68.07 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 177.803 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.456 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -56.38 -43.73 79.5 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.207 178.55 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -65.59 -33.78 76.7 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 119.315 0.961 . . . . 0.0 112.912 -177.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.98 -46.58 64.89 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 175.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -34.36 65.98 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.44 0.638 . . . . 0.0 110.983 -179.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.92 -18.43 68.65 Favored Glycine 0 C--O 1.237 0.333 0 CA-C-O 119.235 -0.759 . . . . 0.0 114.883 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 15.1 t -110.29 -14.64 14.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 117.992 0.896 . . . . 0.0 110.354 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.422 ' HB3' HG13 ' A' ' 471' ' ' VAL . 3.5 mt -65.39 144.01 57.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.0 0.428 . . . . 0.0 110.728 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.464 ' O ' HD13 ' A' ' 512' ' ' ILE . 34.4 tt0 -78.62 84.34 4.73 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 122.46 1.124 . . . . 0.0 109.192 177.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.861 HG21 HD22 ' A' ' 546' ' ' LEU . 29.5 m -97.13 46.77 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-O 123.11 1.433 . . . . 0.0 108.922 -178.423 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.6 t -67.34 172.93 4.34 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.3 m -49.11 -33.68 12.34 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -173.07 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -55.18 -43.06 73.98 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 178.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.464 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.1 mp -88.45 -41.76 14.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.445 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.54 -39.16 83.04 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.404 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -67.13 -32.46 73.6 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.682 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -88.99 -3.85 58.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.999 -0.28 . . . . 0.0 110.56 178.545 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -129.01 42.73 3.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.4 p -64.28 -28.16 69.53 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.499 -0.751 . . . . 0.0 112.248 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -67.51 -24.05 65.53 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.506 0.67 . . . . 0.0 111.952 177.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 60.8 t -71.97 -45.13 65.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 178.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 42.7 t -62.24 -35.51 69.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.77 94.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.175 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 98.6 m -74.41 -38.99 62.94 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 119.168 0.895 . . . . 0.0 110.407 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.676 HD23 HD11 ' A' ' 526' ' ' ILE . 63.5 mt -57.29 -35.15 69.44 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.998 0.428 . . . . 0.0 111.334 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -65.7 -29.23 69.74 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.769 -0.582 . . . . 0.0 111.762 175.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -73.02 -44.42 60.9 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.974 0.416 . . . . 0.0 110.877 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.676 HD11 HD23 ' A' ' 523' ' ' LEU . 17.3 pt -78.54 -21.94 13.16 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.784 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -176.023 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.45 -18.36 58.58 Favored 'General case' 0 C--O 1.214 -0.803 0 O-C-N 121.741 -0.6 . . . . 0.0 111.968 175.402 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.75 19.42 13.16 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 122.897 0.479 . . . . 0.0 111.379 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -64.64 113.67 3.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.97 0.414 . . . . 0.0 112.01 -177.191 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -75.22 -30.0 60.44 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -176.761 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.25 95.77 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -174.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -131.21 110.83 11.42 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.11 -0.329 . . . . 0.0 110.11 -178.171 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 39.3 tptt -56.27 -43.85 79.19 Favored 'General case' 0 C--O 1.207 -1.139 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.211 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -55.49 -42.67 74.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.123 0.487 . . . . 0.0 112.172 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.1 t -57.09 -44.46 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -63.87 -44.24 93.68 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.59 -47.47 78.54 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.11 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 41.5 tptt -70.27 -38.95 75.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 118.488 -1.285 . . . . 0.0 110.715 -178.124 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.06 -40.94 86.72 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.368 0.604 . . . . 0.0 109.392 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -62.9 -48.73 77.7 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.081 -0.963 . . . . 0.0 113.503 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -41.76 89.68 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.2 t -70.51 -52.81 26.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.876 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.514 -177.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 543' ' ' TYR . . . . . 0.531 ' CE1' ' HD3' ' A' ' 547' ' ' LYS . 37.5 t80 -54.91 -42.51 72.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.343 0.592 . . . . 0.0 111.253 -177.386 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.5 m -66.95 -36.9 83.26 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.877 0.37 . . . . 0.0 110.447 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 10.7 mtt85 -63.69 -30.06 71.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.761 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.861 HD22 HG21 ' A' ' 508' ' ' VAL . 13.2 mt -71.7 -38.23 70.59 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -175.514 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 547' ' ' LYS . . . . . 0.531 ' HD3' ' CE1' ' A' ' 543' ' ' TYR . 4.2 mtmp? -61.08 -29.5 69.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.935 -1.029 . . . . 0.0 112.317 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 23.6 m -74.74 -17.46 60.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.582 176.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 73.5 mtt85 -100.45 -33.99 10.12 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -157.03 31.81 0.55 Allowed Glycine 0 C--O 1.226 -0.384 0 N-CA-C 116.251 1.26 . . . . 0.0 116.251 -177.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 N--CA 1.48 1.038 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -179.565 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -75.58 156.51 34.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.069 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 30.9 p -78.52 150.07 75.91 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 176.738 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.74 145.37 62.9 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 116.188 -2.075 . . . . 0.0 112.377 178.625 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 19.8 m -70.72 165.59 22.66 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.607 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.408 HG13 ' HB3' ' A' ' 506' ' ' LEU . 34.1 t -55.17 -46.85 77.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.019 0 O-C-N 122.114 -0.366 . . . . 0.0 110.719 178.364 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.26 -34.15 74.69 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -67.03 -40.93 87.31 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 122.378 1.085 . . . . 0.0 108.678 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -74.08 -34.8 64.13 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.35 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.567 HD21 HG21 ' A' ' 519' ' ' VAL . 4.2 tt -58.88 -36.82 75.28 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.244 177.787 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -57.58 -41.58 81.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 119.244 0.929 . . . . 0.0 109.908 178.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -68.07 -53.18 27.44 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.618 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -46.34 84.96 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -179.404 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.45 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.8 t-160 -58.41 -44.71 89.13 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.0 m -63.17 -38.59 91.77 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.087 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.57 -37.57 88.01 Favored 'General case' 0 CA--C 1.498 -1.03 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.75 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.7 mt -58.95 -42.26 85.51 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.053 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 22.4 mmtt -64.9 -45.36 86.27 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 120.864 0.364 . . . . 0.0 111.7 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -66.9 -28.51 68.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.414 -178.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.96 -17.81 63.32 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 122.722 0.409 . . . . 0.0 111.912 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.8 mt -109.63 12.14 24.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.605 -176.732 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -53.25 128.29 27.54 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.3 t -60.31 -42.36 90.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.825 0.822 . . . . 0.0 109.672 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -71.88 -24.87 61.74 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.378 -1.283 . . . . 0.0 113.168 -177.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 46.5 m -156.34 72.7 5.0 Favored Pre-proline 0 C--O 1.244 0.814 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -176.068 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.93 144.66 43.55 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 115.95 -2.234 . . . . 0.0 112.484 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -137.23 102.04 4.71 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.114 0.483 . . . . 0.0 109.874 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -61.08 -47.33 94.05 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.882 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -178.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -57.26 -31.16 65.29 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 123.118 0.261 . . . . 0.0 110.497 -178.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -69.38 -40.88 77.14 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.403 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.26 -49.56 69.12 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.479 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 70.2 mt -56.89 -44.13 82.01 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -176.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -61.45 -39.14 89.75 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.681 0.753 . . . . 0.0 111.749 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -72.18 -46.58 55.77 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.372 0.606 . . . . 0.0 109.831 178.235 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.403 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.62 -48.67 71.92 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.925 178.335 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -60.84 -35.99 77.97 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -175.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.13 -47.08 53.73 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.145 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.03 -34.48 68.23 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.335 0.588 . . . . 0.0 110.153 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.51 -14.53 64.78 Favored Glycine 0 C--O 1.236 0.224 0 N-CA-C 115.339 0.896 . . . . 0.0 115.339 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 15.1 t -111.97 -16.92 13.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 117.767 0.783 . . . . 0.0 110.493 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.408 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.6 mt -63.88 150.8 44.13 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.213 -0.304 . . . . 0.0 110.947 -178.544 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.464 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.2 tt0 -79.51 84.53 5.37 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-O 122.6 1.19 . . . . 0.0 109.188 178.136 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.896 HG21 HD22 ' A' ' 546' ' ' LEU . 30.0 m -101.04 48.21 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.279 0 CA-C-O 123.367 1.556 . . . . 0.0 108.029 -178.244 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 13.7 t -67.79 171.86 6.03 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.1 m -49.23 -31.0 7.89 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -173.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -55.45 -44.1 76.06 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 122.292 -0.255 . . . . 0.0 111.558 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.464 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.6 -42.36 14.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.543 0 CA-C-O 121.683 0.754 . . . . 0.0 109.275 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.466 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.11 -40.86 82.26 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -174.273 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -72.48 -28.74 63.09 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.399 -175.694 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -88.6 -9.16 53.16 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 122.198 -0.314 . . . . 0.0 110.762 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -125.53 39.71 3.9 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.486 0.66 . . . . 0.0 111.402 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -62.78 -23.87 67.44 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.67 -31.46 72.69 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.995 0.902 . . . . 0.0 112.365 178.046 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.567 HG21 HD21 ' A' ' 475' ' ' LEU . 60.2 t -70.26 -41.76 78.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.02 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 42.0 t -63.39 -37.71 80.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.2 -34.11 77.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.593 177.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 88.0 m -76.59 -39.39 52.72 Favored 'General case' 0 C--O 1.219 -0.509 0 O-C-N 122.172 -0.33 . . . . 0.0 110.414 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.664 HD23 HD11 ' A' ' 526' ' ' ILE . 57.9 mt -59.16 -35.0 72.76 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.215 0.531 . . . . 0.0 110.734 178.94 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -63.47 -29.14 70.47 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 122.007 -0.433 . . . . 0.0 111.159 175.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -73.82 -42.72 60.49 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.664 HD11 HD23 ' A' ' 523' ' ' LEU . 1.5 pt -78.77 -23.06 12.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -178.238 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.37 -13.96 34.9 Favored 'General case' 0 C--O 1.214 -0.791 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 177.039 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -118.59 15.83 13.69 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.094 0.558 . . . . 0.0 111.401 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -69.46 116.93 10.44 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 122.889 0.476 . . . . 0.0 111.409 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -92.35 -16.44 26.0 Favored 'General case' 0 C--O 1.217 -0.605 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -177.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -69.5 -22.23 63.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.472 -178.49 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -150.38 126.27 10.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.584 0.231 . . . . 0.0 110.654 174.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -63.06 -49.29 75.13 Favored 'General case' 0 C--O 1.21 -0.979 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.049 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -57.14 -39.31 74.94 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.259 0.552 . . . . 0.0 111.94 -174.229 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.88 -45.35 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 122.057 -0.402 . . . . 0.0 110.024 176.727 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.2 ttp -67.29 -44.0 80.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 119.407 -0.33 . . . . 0.0 110.2 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -64.04 -47.4 80.35 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -70.3 -37.99 74.88 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 119.245 -0.982 . . . . 0.0 110.954 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.56 -40.93 84.42 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-O 121.83 0.824 . . . . 0.0 108.813 178.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.427 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.78 -51.11 66.31 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.144 -1.389 . . . . 0.0 113.921 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -43.75 84.83 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.93 -52.16 37.24 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.93 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.449 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -54.56 -46.04 73.59 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.583 0.23 . . . . 0.0 110.534 -177.457 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 41.3 m -64.67 -36.56 84.67 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.639 0.776 . . . . 0.0 111.443 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -63.73 -27.84 69.48 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.649 -0.657 . . . . 0.0 110.704 175.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.896 HD22 HG21 ' A' ' 508' ' ' VAL . 11.5 mt -74.47 -36.23 63.29 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -30.62 70.12 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.459 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.2 m -80.1 -15.73 56.51 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.888 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 57.6 mtt85 -99.67 -28.76 13.03 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . 175.66 -176.41 47.44 Favored Glycine 0 C--O 1.236 0.227 0 N-CA-C 112.171 -0.371 . . . . 0.0 112.171 -178.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 71.7 m . . . . . 0 C--O 1.245 0.864 0 CA-C-O 116.848 -1.548 . . . . 0.0 107.449 178.903 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -76.56 152.11 36.08 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 177.675 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 50.5 m -82.99 146.85 52.87 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 176.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -68.63 152.09 74.72 Favored 'Trans proline' 0 C--O 1.246 0.921 0 C-N-CA 116.277 -2.015 . . . . 0.0 113.171 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.4 m -69.93 164.01 24.75 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.805 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 46.9 t -55.93 -47.01 80.51 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.974 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.42 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.2 pt-20 -66.63 -34.17 77.27 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -179.368 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -66.16 -40.27 90.41 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -71.46 -34.69 70.45 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.64 0.733 . . . . 0.0 110.342 -179.541 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -57.12 -39.78 75.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.437 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -53.63 -38.52 64.15 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.938 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -72.96 -54.22 9.2 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.012 175.941 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.81 -48.07 76.04 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -61.85 -40.73 96.37 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 66.8 m -63.86 -41.07 97.87 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.612 179.686 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.73 -41.92 95.59 Favored 'General case' 0 CA--C 1.5 -0.961 0 C-N-CA 120.858 -0.337 . . . . 0.0 111.017 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.73 -46.14 73.81 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.273 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.253 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -67.78 -39.52 84.08 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -68.48 -30.55 69.42 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 120.717 0.294 . . . . 0.0 110.621 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.17 -18.84 65.45 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.6 mt -105.35 12.09 32.03 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.345 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -54.82 130.56 41.43 Favored 'General case' 0 C--O 1.21 -1.006 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.1 t -63.93 -41.19 91.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-O 122.152 0.977 . . . . 0.0 109.063 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -68.64 -28.49 66.94 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.919 -1.492 . . . . 0.0 113.24 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 66.3 m -158.93 76.2 3.28 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.66 146.64 49.38 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 115.702 -2.399 . . . . 0.0 111.794 178.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -137.31 91.32 2.6 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.749 0.785 . . . . 0.0 110.14 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.4 HG12 ' H ' ' A' ' 493' ' ' VAL . 1.3 p -57.21 -46.97 84.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 -177.439 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -58.87 -30.97 68.13 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -177.681 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -70.2 -41.91 73.06 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.444 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.02 -49.46 72.3 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 176.56 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.7 mt -57.3 -42.61 82.11 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -176.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -65.17 -39.18 92.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.369 0.604 . . . . 0.0 111.407 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.62 -47.65 69.03 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.444 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.21 -44.78 79.83 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.389 177.638 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -66.8 -34.31 77.55 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 119.264 0.938 . . . . 0.0 113.493 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -69.1 -45.11 71.05 Favored 'General case' 0 C--O 1.225 -0.216 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 176.215 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.59 -33.37 66.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.543 0.687 . . . . 0.0 110.069 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.25 -16.17 64.34 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-O 119.181 -0.788 . . . . 0.0 114.656 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.7 t -114.82 -12.44 12.1 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.311 1.056 . . . . 0.0 110.815 179.346 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.1 mt -67.47 144.92 55.46 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.752 -0.593 . . . . 0.0 111.179 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.422 ' O ' HD13 ' A' ' 512' ' ' ILE . 2.2 mt-30 -76.44 84.35 3.17 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-O 122.684 1.231 . . . . 0.0 109.279 177.07 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.914 HG21 HD22 ' A' ' 546' ' ' LEU . 29.1 m -97.99 46.91 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 CA-C-O 122.596 1.189 . . . . 0.0 109.127 -178.283 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.7 t -67.41 172.84 4.5 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 46.1 m -49.32 -33.92 14.42 Favored 'General case' 0 C--O 1.218 -0.596 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -174.313 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -53.33 -44.86 68.78 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.422 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.35 -42.6 14.93 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.435 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.28 -39.17 78.54 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -175.196 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -70.26 -29.71 66.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.114 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -90.16 -2.45 58.07 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.345 -0.222 . . . . 0.0 110.95 177.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -129.61 45.48 2.8 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.759 0.79 . . . . 0.0 111.999 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.4 p -64.84 -28.53 69.62 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.731 -0.606 . . . . 0.0 112.515 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -67.04 -26.27 66.68 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.508 0.671 . . . . 0.0 111.885 178.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.84 -43.42 79.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 41.6 t -63.85 -35.43 73.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.63 -38.21 89.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 119.305 -0.378 . . . . 0.0 110.963 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.6 m -75.43 -39.24 59.13 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 118.999 0.818 . . . . 0.0 109.654 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.525 HD23 HD11 ' A' ' 526' ' ' ILE . 46.8 mt -57.57 -35.0 69.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.03 0.443 . . . . 0.0 111.394 178.395 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -64.66 -29.16 70.15 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.878 -0.514 . . . . 0.0 111.561 175.18 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -73.4 -49.02 29.27 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.622 0.248 . . . . 0.0 110.984 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.525 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -73.34 -21.9 19.01 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.963 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 -175.326 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -60.45 -18.35 50.72 Favored 'General case' 0 C--O 1.214 -0.785 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 176.639 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -118.81 19.37 13.14 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 122.911 0.484 . . . . 0.0 111.279 176.711 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -63.19 113.6 3.27 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 121.156 0.503 . . . . 0.0 111.842 -176.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -75.54 -30.97 59.91 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 115.686 1.736 . . . . 0.0 115.686 -176.009 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.65 -42.43 95.44 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.032 0.444 . . . . 0.0 112.159 -174.774 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -129.88 109.81 11.2 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.4 tptt -56.06 -42.47 76.7 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.938 178.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -55.7 -43.08 76.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.154 0.502 . . . . 0.0 111.795 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 69.2 t -57.99 -43.74 85.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 177.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -44.63 95.8 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.78 -47.74 77.02 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.605 -0.438 . . . . 0.0 112.013 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -68.59 -39.94 80.72 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.854 -178.407 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.42 -41.11 88.76 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.442 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.26 -48.33 78.63 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -42.15 95.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.253 0.549 . . . . 0.0 109.681 -179.408 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 77.3 t -70.57 -51.63 35.68 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.456 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -53.44 -45.26 69.4 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 122.526 0.33 . . . . 0.0 110.841 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 22.6 m -65.03 -36.91 85.9 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 122.925 0.49 . . . . 0.0 111.342 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 42.2 mtt85 -62.0 -28.95 69.93 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 121.672 -0.643 . . . . 0.0 110.661 176.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.914 HD22 HG21 ' A' ' 508' ' ' VAL . 5.5 mt -76.51 -31.72 57.84 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 -176.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 -31.64 72.48 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.81 177.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 16.2 m -81.64 -8.53 59.72 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 177.017 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -110.96 -16.9 13.42 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -118.82 177.44 16.41 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -178.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.254 1.317 0 C-N-CA 126.689 1.996 . . . . 0.0 106.888 -178.155 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.761 0 CA-C-O 118.592 -0.718 . . . . 0.0 109.568 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 54.47 32.28 16.41 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 121.836 0.827 . . . . 0.0 109.85 -176.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 62.8 p -140.43 67.39 31.08 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.463 -175.354 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -69.41 148.82 68.2 Favored 'Trans proline' 0 C--O 1.238 0.507 0 C-N-CA 116.918 -1.588 . . . . 0.0 113.112 -178.703 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.7 m -69.49 161.41 29.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.891 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.4 t -54.25 -45.91 67.88 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -65.03 -34.07 77.55 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.03 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -66.44 -41.36 89.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -73.21 -33.3 65.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.808 -176.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.476 HD21 HG21 ' A' ' 519' ' ' VAL . 5.1 tt -59.69 -35.49 74.6 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.631 178.05 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -58.12 -40.27 80.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 119.037 0.835 . . . . 0.0 110.053 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -65.32 -55.83 16.09 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.403 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -45.8 90.37 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -177.194 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.445 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.9 t-160 -58.61 -42.72 88.82 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 53.9 m -64.63 -39.08 93.07 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 121.197 -0.201 . . . . 0.0 111.434 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.415 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.3 mm-40 -63.54 -37.67 88.18 Favored 'General case' 0 CA--C 1.508 -0.653 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.6 178.589 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.6 mt -59.17 -43.02 88.55 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -63.45 -44.92 93.11 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.75 -32.4 73.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.79 0.329 . . . . 0.0 110.979 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.58 -17.34 64.6 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.3 mt -109.69 12.06 24.33 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -55.29 132.4 47.81 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 177.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.73 -41.45 92.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 122.316 1.055 . . . . 0.0 108.723 177.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -66.42 -31.22 71.85 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 113.519 -1.673 . . . . 0.0 113.152 -178.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 11.1 t -160.48 76.97 2.65 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -175.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -73.99 144.95 34.94 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 116.68 -1.747 . . . . 0.0 112.716 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -137.34 102.24 4.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.685 0.755 . . . . 0.0 110.88 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.446 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.5 OUTLIER -60.11 -45.39 95.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -179.098 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -59.66 -31.9 69.97 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -70.1 -41.13 74.43 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -177.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -48.75 73.1 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 176.125 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 87.5 mt -56.94 -44.59 82.66 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -176.369 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -63.16 -39.04 93.51 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.799 0.809 . . . . 0.0 111.446 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.71 -47.27 63.74 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.448 0.642 . . . . 0.0 109.934 178.693 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.59 -48.26 75.13 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.641 178.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.36 -36.6 82.73 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -175.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -70.05 -45.7 66.55 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -35.77 70.42 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.295 0.569 . . . . 0.0 110.054 -179.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.91 -17.65 67.75 Favored Glycine 0 C--O 1.244 0.762 0 N-CA-C 115.288 0.875 . . . . 0.0 115.288 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.9 t -108.56 -13.43 14.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.512 0.656 . . . . 0.0 109.822 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.1 mt -69.99 149.47 47.7 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.466 ' O ' HD13 ' A' ' 512' ' ' ILE . 35.4 tt0 -79.82 84.39 5.62 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-O 122.56 1.172 . . . . 0.0 109.281 177.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.941 HG21 HD22 ' A' ' 546' ' ' LEU . 27.3 m -98.16 47.93 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 CA-C-O 123.247 1.499 . . . . 0.0 107.608 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.9 t -66.31 173.68 3.09 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 113.807 -1.542 . . . . 0.0 107.167 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.3 m -49.38 -34.67 16.69 Favored 'General case' 0 C--O 1.215 -0.713 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -54.28 -45.15 72.43 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 177.623 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -86.52 -40.0 13.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 CA-C-O 121.691 0.758 . . . . 0.0 109.324 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.4 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.79 -38.16 81.13 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -175.979 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -67.1 -35.0 78.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.348 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -86.83 -6.86 58.67 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.116 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -128.74 45.64 2.75 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.914 0.864 . . . . 0.0 112.924 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.9 p -65.0 -24.23 67.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.357 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.08 -33.84 76.68 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.56 1.172 . . . . 0.0 112.231 178.322 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.476 HG21 HD21 ' A' ' 475' ' ' LEU . 86.1 t -68.43 -43.45 84.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.3 t -63.43 -37.1 78.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.36 -36.68 84.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.582 177.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.6 m -75.58 -39.73 57.64 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 118.215 0.461 . . . . 0.0 109.797 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.59 HD23 HD11 ' A' ' 526' ' ' ILE . 55.4 mt -58.19 -34.88 70.84 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.921 0.391 . . . . 0.0 111.257 178.651 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -64.22 -29.07 70.19 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.858 -0.526 . . . . 0.0 111.317 175.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -73.76 -46.02 48.27 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.72 0.295 . . . . 0.0 111.401 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.59 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -77.49 -20.6 14.07 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.164 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -176.956 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.466 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.21 -15.6 47.74 Favored 'General case' 0 C--O 1.211 -0.957 0 O-C-N 121.952 -0.467 . . . . 0.0 112.156 176.056 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -119.21 19.33 12.88 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.155 0.582 . . . . 0.0 111.456 176.067 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -63.75 116.25 5.55 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.276 0.56 . . . . 0.0 112.294 -175.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -83.18 -27.99 29.65 Favored 'General case' 0 C--O 1.216 -0.667 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -177.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.26 -27.38 66.28 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.981 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -147.97 114.94 6.12 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 177.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -63.12 -38.27 90.5 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -175.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -58.77 -38.94 79.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.919 0.39 . . . . 0.0 111.481 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.6 t -58.47 -44.64 89.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 177.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 3.3 ttp -64.22 -42.03 96.76 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 110.445 -0.206 . . . . 0.0 110.445 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.3 -49.43 74.04 Favored 'General case' 0 C--N 1.32 -0.713 0 O-C-N 123.191 0.307 . . . . 0.0 111.164 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.6 tptt -71.33 -38.05 71.7 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 118.868 -1.133 . . . . 0.0 111.335 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.7 -40.91 85.02 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.466 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.7 -51.12 66.42 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.748 -1.115 . . . . 0.0 113.904 178.263 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -44.03 90.16 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 -179.437 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.7 t -67.4 -51.23 54.56 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.957 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.811 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -54.26 -44.67 72.0 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -178.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 28.1 m -65.28 -39.21 92.26 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.132 0.573 . . . . 0.0 111.3 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 43.1 mtt-85 -57.95 -31.74 67.13 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 121.844 -0.535 . . . . 0.0 110.109 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.941 HD22 HG21 ' A' ' 508' ' ' VAL . 4.1 mt -76.62 -31.79 57.63 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -175.649 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 -38.89 91.25 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.772 177.386 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 18.1 m -74.9 -15.51 60.7 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 178.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.7 mtt-85 -98.17 -7.0 30.25 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -122.55 -173.23 14.18 Favored Glycine 0 CA--C 1.507 -0.421 0 CA-C-O 119.674 -0.514 . . . . 0.0 112.702 -174.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.256 1.42 0 CA-C-O 116.005 -1.95 . . . . 0.0 107.1 -177.336 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.982 0 CA-C-O 118.635 -0.697 . . . . 0.0 109.436 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -63.0 -36.58 84.04 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 175.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 25.0 m -100.74 147.04 33.1 Favored Pre-proline 0 C--O 1.244 0.81 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 172.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.03 151.38 82.02 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 118.395 -0.603 . . . . 0.0 113.261 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 5.5 m -74.1 166.01 24.14 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.181 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -53.35 -45.54 56.68 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.956 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -33.62 75.98 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -178.825 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -70.59 -40.37 73.27 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -74.1 -31.66 62.9 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.708 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.34 -39.24 66.89 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.239 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -53.21 -38.74 63.14 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.4 0.148 . . . . 0.0 111.4 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -67.89 -58.22 4.93 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.332 176.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -46.48 88.87 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -174.414 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.2 t-160 -59.29 -41.15 88.27 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 59.5 m -65.64 -39.32 91.29 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 118.184 0.447 . . . . 0.0 111.46 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.476 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 10.9 mm-40 -63.28 -38.03 89.55 Favored 'General case' 0 CA--C 1.506 -0.721 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.92 178.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.63 -43.13 86.74 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.121 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 179.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 53.9 mmtt -63.18 -45.6 91.04 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.04 -33.1 75.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.885 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.78 -18.48 65.39 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 30.9 mt -108.45 12.02 26.51 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 -177.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 47.3 mttt -55.18 129.18 37.25 Favored 'General case' 0 C--O 1.21 -0.985 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 176.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 53.8 t -62.92 -41.81 94.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-O 122.261 1.029 . . . . 0.0 108.638 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -68.51 -26.77 65.62 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.592 -1.64 . . . . 0.0 113.573 -179.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 26.8 m -158.12 73.04 4.02 Favored Pre-proline 0 N--CA 1.473 0.722 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.21 145.14 34.31 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 115.728 -2.381 . . . . 0.0 112.79 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -137.23 97.78 3.57 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.714 0.769 . . . . 0.0 110.553 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.436 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.7 OUTLIER -57.39 -46.57 85.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -179.412 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -58.42 -32.1 68.35 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -71.19 -40.64 71.09 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 -176.767 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.459 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -64.3 -49.43 71.83 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 175.792 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.6 mt -56.84 -43.28 80.94 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -176.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -65.54 -38.07 88.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.471 0.653 . . . . 0.0 111.795 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.476 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -66.04 -48.52 70.81 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.818 0.818 . . . . 0.0 109.33 177.935 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.459 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.23 -43.43 82.87 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.059 178.581 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -60.6 -37.47 81.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 119.035 0.834 . . . . 0.0 112.476 -177.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.02 -41.45 59.3 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.518 -0.873 . . . . 0.0 108.84 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.7 -34.01 69.0 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.422 0.629 . . . . 0.0 110.108 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.38 -19.31 66.42 Favored Glycine 0 N--CA 1.452 -0.29 0 N-CA-C 114.915 0.726 . . . . 0.0 114.915 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.7 t -112.41 -13.81 13.35 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.102 0.951 . . . . 0.0 110.925 -178.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.72 144.66 56.76 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.817 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.441 ' O ' HD13 ' A' ' 512' ' ' ILE . 29.5 tt0 -77.84 84.78 4.14 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-O 122.814 1.293 . . . . 0.0 109.561 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.919 HG21 HD22 ' A' ' 546' ' ' LEU . 27.6 m -97.22 48.11 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-O 122.862 1.315 . . . . 0.0 108.281 -178.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.6 t -66.62 172.75 3.9 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 22.5 m -49.22 -33.28 12.21 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -174.275 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -55.44 -44.32 76.22 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.323 -0.236 . . . . 0.0 111.442 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.441 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -86.13 -42.06 15.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.455 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.41 -37.28 80.35 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -174.909 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -67.82 -31.75 71.82 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.524 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -89.73 -4.71 57.57 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 121.016 -0.273 . . . . 0.0 110.599 178.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -128.48 46.32 2.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.596 0.712 . . . . 0.0 112.24 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 25.7 p -65.59 -25.6 67.47 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 121.455 -0.778 . . . . 0.0 112.257 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.71 -29.08 68.24 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 122.682 1.229 . . . . 0.0 112.405 178.247 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 79.5 t -68.62 -44.74 82.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.4 t -63.86 -37.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.93 -35.35 79.82 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.867 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 92.3 m -77.46 -38.85 48.44 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 118.749 0.704 . . . . 0.0 109.41 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.554 HD23 HD11 ' A' ' 526' ' ' ILE . 43.8 mt -58.21 -35.21 71.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.06 0.457 . . . . 0.0 111.117 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -64.5 -29.11 70.15 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.923 -0.486 . . . . 0.0 111.486 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -74.29 -42.12 60.07 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.006 0.372 . . . . 0.0 112.006 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.554 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.84 -22.7 12.88 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.002 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 -178.047 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -16.87 55.99 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 176.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -118.74 19.34 13.19 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 123.323 0.649 . . . . 0.0 111.336 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -67.5 110.75 3.78 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -73.82 -30.34 62.65 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -176.784 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.1 -41.85 97.12 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -174.585 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -131.53 109.29 10.16 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -178.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -54.99 -43.34 73.46 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.97 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -55.03 -42.76 73.0 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.995 0.426 . . . . 0.0 111.999 -177.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 74.7 t -58.14 -44.46 87.57 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -62.53 -44.61 95.92 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.07 -47.16 78.25 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.38 -0.528 . . . . 0.0 112.185 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.0 tptt -68.67 -39.43 80.63 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.295 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.5 -40.23 86.39 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 121.59 0.709 . . . . 0.0 109.113 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -64.49 -48.95 73.26 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.703 -1.135 . . . . 0.0 113.113 179.181 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -42.74 90.74 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.7 t -69.45 -52.01 36.71 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.912 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.276 -178.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -54.0 -46.07 71.65 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 122.291 0.236 . . . . 0.0 110.661 -176.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 17.3 m -65.97 -35.28 80.15 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 122.884 0.474 . . . . 0.0 111.026 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -61.74 -29.69 70.28 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.775 -0.578 . . . . 0.0 110.154 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.919 HD22 HG21 ' A' ' 508' ' ' VAL . 8.6 mt -76.52 -32.13 58.09 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 -175.232 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.05 -28.89 69.92 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.601 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 23.0 m -80.19 -8.73 59.57 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.336 176.691 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 65.1 mtt85 -112.48 -23.04 10.52 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -167.46 163.21 36.96 Favored Glycine 0 C--O 1.236 0.238 0 N-CA-C 110.424 -1.07 . . . . 0.0 110.424 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 C--O 1.249 1.064 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -176.614 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.654 -0.688 . . . . 0.0 109.65 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 62.2 178.41 0.13 Allowed 'General case' 0 N--CA 1.473 0.697 0 O-C-N 124.627 1.204 . . . . 0.0 111.064 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 19.4 m -133.85 67.63 74.5 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.676 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.97 148.29 63.36 Favored 'Trans proline' 0 C--O 1.238 0.499 0 C-N-CA 117.323 -1.318 . . . . 0.0 113.433 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.0 m -68.78 164.47 21.77 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.5 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.418 HG13 ' HB3' ' A' ' 506' ' ' LEU . 40.1 t -54.16 -47.92 66.53 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 O-C-N 122.027 -0.421 . . . . 0.0 111.702 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.411 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.1 pt-20 -61.69 -34.18 75.3 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -178.347 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.13 -42.24 80.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 122.237 1.018 . . . . 0.0 108.46 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -71.65 -35.32 70.33 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.469 -177.64 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.452 HD21 HG21 ' A' ' 519' ' ' VAL . 4.6 tt -58.15 -35.38 71.45 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.72 178.408 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -56.7 -42.15 78.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 118.966 0.803 . . . . 0.0 109.778 177.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -68.37 -53.8 21.51 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.727 178.257 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -46.15 83.69 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 112.284 0.475 . . . . 0.0 112.284 -178.234 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.46 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.3 t-160 -58.09 -44.72 87.76 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.7 m -63.14 -38.22 90.31 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.437 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.3 mm-40 -64.66 -37.43 87.54 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.43 178.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.1 mt -58.92 -43.42 88.56 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.7 mmtt -63.66 -42.14 98.12 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -66.95 -34.69 78.32 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 120.788 0.327 . . . . 0.0 110.583 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -16.12 63.94 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 36.4 mt -111.94 12.08 20.72 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -58.56 133.24 55.66 Favored 'General case' 0 CA--C 1.489 -1.379 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 15.7 m -69.23 -16.13 20.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.022 177.682 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -91.89 -23.53 19.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.949 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 50.6 m -161.15 73.55 2.62 Favored Pre-proline 0 N--CA 1.469 0.494 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -175.577 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.35 142.55 33.65 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 113.822 -3.652 . . . . 0.0 112.381 178.388 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -137.36 101.86 4.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.589 0.709 . . . . 0.0 110.532 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.452 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.4 OUTLIER -57.54 -45.4 86.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.015 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 13.2 pttt -59.53 -32.32 70.2 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-O 121.718 0.77 . . . . 0.0 109.605 -176.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -71.53 -39.63 70.6 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.064 -176.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.425 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -66.71 -49.15 66.97 Favored 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.889 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 91.4 mt -56.9 -43.3 81.21 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 111.519 0.192 . . . . 0.0 111.519 -176.839 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -65.89 -33.23 75.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.418 0.628 . . . . 0.0 112.204 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.437 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -72.62 -47.06 50.9 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.671 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.425 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.53 -45.87 80.9 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.439 179.434 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -60.46 -36.32 77.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 119.063 0.847 . . . . 0.0 112.688 -176.67 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.36 -47.32 43.23 Favored 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.76 -35.01 68.14 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.183 0.516 . . . . 0.0 110.768 -178.372 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.75 -18.05 69.88 Favored Glycine 0 C--O 1.241 0.592 0 N-CA-C 115.156 0.822 . . . . 0.0 115.156 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.0 t -108.63 -14.16 14.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 117.554 0.677 . . . . 0.0 110.059 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.418 ' HB3' HG13 ' A' ' 471' ' ' VAL . 3.4 mt -67.82 148.49 51.13 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.417 ' O ' HD13 ' A' ' 512' ' ' ILE . 32.1 tt0 -79.09 84.25 5.1 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-O 122.734 1.254 . . . . 0.0 108.785 177.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.959 HG21 HD22 ' A' ' 546' ' ' LEU . 30.3 m -98.92 49.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.353 0 CA-C-O 123.133 1.444 . . . . 0.0 107.527 -178.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.4 t -67.1 173.15 3.94 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 34.4 m -49.32 -32.37 10.99 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -174.055 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.53 -44.46 76.72 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 177.698 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.417 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -88.05 -42.52 15.01 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 CA-C-O 121.62 0.724 . . . . 0.0 109.264 -179.152 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.477 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.48 -40.08 81.76 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -175.396 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -70.21 -31.05 68.32 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.191 -177.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -88.65 -7.85 55.64 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.397 178.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -126.29 40.85 3.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.564 0.697 . . . . 0.0 111.745 -178.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 11.6 p -62.66 -24.02 67.41 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 -179.144 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.4 -31.09 72.15 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.557 0.694 . . . . 0.0 112.102 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.46 HG22 ' CG ' ' A' ' 479' ' ' HIS . 24.3 t -70.92 -41.99 77.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 38.3 t -62.91 -38.46 81.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.48 -32.59 74.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.613 177.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.4 m -79.68 -39.38 31.46 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.479 HD23 HD11 ' A' ' 526' ' ' ILE . 37.1 mt -58.27 -35.65 72.1 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.199 0.523 . . . . 0.0 111.069 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -63.52 -29.09 70.41 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 122.117 -0.365 . . . . 0.0 111.412 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -74.07 -44.3 54.61 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 122.318 -0.239 . . . . 0.0 111.637 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.479 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -78.81 -19.96 13.02 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -176.997 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.86 -13.44 44.95 Favored 'General case' 0 C--O 1.212 -0.896 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 176.542 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -120.88 19.38 11.74 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 122.999 0.52 . . . . 0.0 111.505 176.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -64.98 118.82 9.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.111 0.482 . . . . 0.0 112.183 -177.043 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -83.79 -29.7 27.18 Favored 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -177.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.12 99.39 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.32 0.581 . . . . 0.0 111.488 -174.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.9 m120 -132.9 111.61 11.2 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -60.32 -36.53 78.13 Favored 'General case' 0 C--O 1.21 -0.993 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.793 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -57.1 -42.3 80.52 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.241 0.543 . . . . 0.0 112.138 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.4 t -58.5 -43.08 86.13 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.117 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 5.3 ttp -64.8 -40.82 95.86 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -63.87 -51.55 64.06 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -70.34 -38.79 74.91 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 119.289 -0.964 . . . . 0.0 111.751 -177.729 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.79 -39.4 80.96 Favored 'General case' 0 C--O 1.212 -0.878 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.421 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.71 -48.77 70.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.518 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -42.25 91.87 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.1 t -70.4 -50.29 47.08 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.452 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -55.93 -44.97 78.84 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.643 0.258 . . . . 0.0 110.36 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 19.1 m -67.63 -33.64 75.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.339 0.59 . . . . 0.0 110.954 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 10.9 mtt85 -61.44 -28.52 69.33 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 121.78 -0.575 . . . . 0.0 109.932 175.069 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.959 HD22 HG21 ' A' ' 508' ' ' VAL . 11.0 mt -76.68 -35.22 58.06 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 -175.549 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -27.74 69.35 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.395 177.939 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.1 m -81.53 -8.77 59.76 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 114.693 -1.14 . . . . 0.0 111.739 177.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -113.8 -24.41 9.15 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -162.62 165.73 36.36 Favored Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 111.827 -0.509 . . . . 0.0 111.827 -178.108 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 7.5 m . . . . . 0 C--O 1.247 0.969 0 CA-C-O 118.68 -0.676 . . . . 0.0 112.712 -177.043 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -77.02 171.82 14.19 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 176.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 26.8 p -71.28 144.95 90.19 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 176.37 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -67.98 146.24 70.55 Favored 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 117.376 -1.283 . . . . 0.0 114.239 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.7 m -71.17 167.0 20.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.335 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.416 HG13 ' HB3' ' A' ' 506' ' ' LEU . 25.7 t -53.18 -48.63 54.12 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -34.09 77.16 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -66.17 -39.57 89.85 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -74.33 -35.87 63.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.03 -178.192 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.496 HD21 HG21 ' A' ' 519' ' ' VAL . 5.3 tt -59.03 -35.51 73.43 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.531 177.737 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -56.38 -41.03 75.57 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.287 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -69.64 -53.22 19.76 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.43 -46.35 83.65 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.015 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -59.39 -41.82 90.26 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.6 m -64.66 -41.16 96.28 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.289 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.472 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 16.3 mm-40 -62.79 -41.94 99.49 Favored 'General case' 0 CA--C 1.503 -0.841 0 CA-C-N 117.964 0.347 . . . . 0.0 110.648 178.245 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.93 -46.9 76.48 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.206 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -67.47 -37.52 83.04 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -67.41 -32.61 73.62 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.77 0.319 . . . . 0.0 110.265 177.768 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.34 -17.8 64.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 179.171 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 31.6 mt -105.84 12.06 31.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 2.9 mttt -54.81 129.01 35.56 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 176.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.27 -40.46 89.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 CA-C-O 122.809 1.29 . . . . 0.0 107.852 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -65.12 -28.48 69.46 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.81 -1.996 . . . . 0.0 113.441 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 69.5 m -162.26 75.45 2.17 Favored Pre-proline 0 N--CA 1.474 0.73 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -73.5 143.75 35.01 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 114.741 -3.039 . . . . 0.0 112.605 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -137.21 100.91 4.39 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.398 0.618 . . . . 0.0 110.09 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -59.5 -46.72 92.64 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.891 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -57.11 -32.06 65.92 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -69.9 -40.43 75.63 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 119.868 -0.733 . . . . 0.0 109.162 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.421 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.01 -48.33 74.3 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.033 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.1 mt -56.96 -44.38 82.55 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 117.944 0.338 . . . . 0.0 111.855 -176.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.2 t30 -61.6 -38.92 89.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.797 0.808 . . . . 0.0 111.541 179.203 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.72 -48.55 59.11 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.5 0.667 . . . . 0.0 109.791 178.155 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.421 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.44 -48.51 71.62 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.162 178.708 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.99 -35.82 79.65 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -175.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -46.73 61.68 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 176.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.04 -34.27 68.05 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.368 0.604 . . . . 0.0 110.247 -178.628 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.17 -17.47 68.08 Favored Glycine 0 C--O 1.241 0.533 0 N-CA-C 115.101 0.801 . . . . 0.0 115.101 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.8 t -110.99 -12.06 14.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 117.867 0.834 . . . . 0.0 110.081 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.416 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.1 mt -69.63 147.48 50.61 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 121.917 -0.489 . . . . 0.0 110.057 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.414 ' O ' HD13 ' A' ' 512' ' ' ILE . 36.1 tt0 -78.73 84.48 4.81 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-O 122.83 1.3 . . . . 0.0 108.965 177.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.892 HG21 HD22 ' A' ' 546' ' ' LEU . 28.4 m -99.05 46.32 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 -179.397 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.1 t -66.16 169.69 6.73 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 -177.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 22.9 m -49.29 -29.4 5.88 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 114.266 1.209 . . . . 0.0 114.266 -174.179 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -55.62 -47.53 76.42 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.309 -0.244 . . . . 0.0 111.322 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.414 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -86.03 -39.84 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 CA-C-O 121.424 0.63 . . . . 0.0 109.513 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.442 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.92 -36.53 77.2 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -175.658 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -66.64 -32.94 74.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.786 0.803 . . . . 0.0 111.384 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -92.5 -1.13 57.18 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.997 -1.002 . . . . 0.0 111.753 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -132.29 43.25 3.03 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.663 0.744 . . . . 0.0 112.457 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 21.2 p -64.44 -25.57 68.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.14 -32.2 73.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.725 0.774 . . . . 0.0 112.354 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.496 HG21 HD21 ' A' ' 475' ' ' LEU . 61.5 t -68.39 -41.34 83.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.6 t -63.39 -37.01 78.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 178.417 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.72 -38.22 89.63 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.535 177.472 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 99.2 m -74.85 -38.11 62.06 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 118.5 0.591 . . . . 0.0 110.455 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.689 HD23 HD11 ' A' ' 526' ' ' ILE . 65.1 mt -58.82 -34.15 71.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.98 0.419 . . . . 0.0 111.034 178.21 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -65.08 -29.19 70.05 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.755 -0.59 . . . . 0.0 111.26 175.262 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -73.14 -42.73 62.54 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 122.239 -0.288 . . . . 0.0 111.441 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.689 HD11 HD23 ' A' ' 523' ' ' LEU . 2.2 pt -78.87 -24.13 13.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.04 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.423 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.59 -14.09 38.72 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 121.736 -0.602 . . . . 0.0 112.187 176.611 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -118.72 18.69 13.35 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.357 0.663 . . . . 0.0 111.516 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -68.74 106.26 2.59 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -175.736 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -75.97 -23.23 55.33 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.54 -24.4 64.63 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -177.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -151.67 126.18 9.47 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.511 -0.475 . . . . 0.0 112.062 174.357 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 46.4 tptt -62.21 -50.13 73.0 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.408 -178.425 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -57.82 -39.82 78.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.251 0.548 . . . . 0.0 111.455 -174.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 54.8 t -56.1 -45.36 80.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 176.829 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.8 ttp -67.41 -43.41 81.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.542 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -64.24 -47.64 78.89 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.0 tptt -69.48 -37.94 77.47 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.669 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 539' ' ' ALA . . . . . 0.419 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -58.82 -41.57 87.17 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.27 -51.09 67.57 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.599 -1.182 . . . . 0.0 113.322 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -44.71 90.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 -179.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.5 t -67.75 -50.0 64.45 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.998 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.179 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -54.58 -44.58 73.12 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.6 m -65.46 -39.04 91.54 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 122.925 0.49 . . . . 0.0 111.317 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 35.8 mtt-85 -57.74 -31.74 66.76 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 121.874 -0.516 . . . . 0.0 110.447 175.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.892 HD22 HG21 ' A' ' 508' ' ' VAL . 3.3 mt -76.69 -31.7 57.4 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.645 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -37.83 88.62 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.45 178.267 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.2 m -70.2 -8.94 53.97 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 77.0 mtt85 -113.25 9.37 18.36 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.562 0.345 . . . . 0.0 110.129 177.606 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -94.8 -170.07 36.97 Favored Glycine 0 C--O 1.226 -0.401 0 C-N-CA 121.349 -0.453 . . . . 0.0 112.772 -176.356 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 C--O 1.243 0.738 0 C-N-CA 124.244 1.017 . . . . 0.0 111.833 -178.984 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 118.751 -0.643 . . . . 0.0 109.427 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -62.41 -34.67 77.19 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 175.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 29.9 m -104.57 145.1 30.05 Favored Pre-proline 0 C--O 1.244 0.787 0 N-CA-C 105.141 -2.17 . . . . 0.0 105.141 171.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -67.51 154.24 74.23 Favored 'Trans proline' 0 CA--C 1.533 0.453 0 O-C-N 122.213 0.586 . . . . 0.0 112.901 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.8 m -72.68 165.44 24.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.419 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.411 HG13 ' HB3' ' A' ' 506' ' ' LEU . 51.8 t -54.31 -47.55 68.82 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.947 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.874 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.433 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.7 pt-20 -63.38 -33.9 76.56 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 122.525 0.33 . . . . 0.0 111.781 -178.655 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -68.36 -41.56 80.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 178.413 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -72.74 -32.72 65.89 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.842 -176.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.445 HD23 HD21 ' A' ' 503' ' ' LEU . 1.2 tm? -56.35 -35.61 67.85 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.698 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -54.7 -39.95 68.68 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.952 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 39.1 tttt -66.46 -54.3 25.68 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 176.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -47.36 85.66 Favored 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -176.282 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -61.01 -40.57 94.06 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 66.1 m -64.04 -41.93 97.24 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.424 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -63.91 -42.69 97.35 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-O 119.426 -0.321 . . . . 0.0 111.349 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.43 -46.44 70.48 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.272 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -68.09 -38.42 82.33 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -176.858 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -68.37 -31.19 70.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.709 0.29 . . . . 0.0 110.245 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -19.17 65.71 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.5 mt -105.84 12.15 31.1 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -55.62 129.41 38.96 Favored 'General case' 0 C--O 1.209 -1.038 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 177.218 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.7 t -63.15 -40.64 89.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 122.363 1.078 . . . . 0.0 108.504 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -68.43 -27.14 65.92 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 113.491 -1.686 . . . . 0.0 113.148 -178.566 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 49.4 m -159.43 74.0 3.29 Favored Pre-proline 0 N--CA 1.47 0.563 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -176.495 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.45 145.93 43.59 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 114.701 -3.066 . . . . 0.0 112.372 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -137.3 91.74 2.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.523 0.678 . . . . 0.0 110.154 -176.015 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.414 HG12 ' H ' ' A' ' 493' ' ' VAL . 1.1 p -57.37 -46.02 85.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -177.462 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -58.06 -31.36 66.98 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 120.843 0.354 . . . . 0.0 110.089 -177.889 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -70.9 -42.08 70.42 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 -177.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.486 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -63.26 -49.44 74.09 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 176.602 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 80.8 mt -57.01 -42.89 81.2 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -176.383 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -66.01 -38.35 88.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.297 0.57 . . . . 0.0 111.468 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -65.77 -48.25 72.45 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.658 0.742 . . . . 0.0 109.22 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.486 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.76 -44.52 81.85 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.552 177.425 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -62.41 -36.97 84.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 119.161 0.891 . . . . 0.0 112.32 -177.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -71.77 -43.92 64.9 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.445 HD21 HD23 ' A' ' 475' ' ' LEU . 0.8 OUTLIER -60.8 -31.71 71.09 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.399 0.619 . . . . 0.0 110.246 -179.111 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.82 -17.41 62.84 Favored Glycine 0 C--O 1.24 0.517 0 CA-C-O 119.507 -0.607 . . . . 0.0 114.494 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 12.2 t -114.85 -13.36 11.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.742 0.771 . . . . 0.0 111.048 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.411 ' HB3' HG13 ' A' ' 471' ' ' VAL . 2.2 mt -67.0 146.41 54.39 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.197 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.439 ' O ' HD13 ' A' ' 512' ' ' ILE . 35.5 tt0 -77.67 84.22 4.02 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 122.515 1.15 . . . . 0.0 110.17 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.892 HG21 HD22 ' A' ' 546' ' ' LEU . 26.9 m -98.27 47.56 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 CA-C-O 122.942 1.353 . . . . 0.0 109.079 -178.398 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.2 t -66.94 173.61 3.53 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 20.1 m -49.38 -32.99 12.61 Favored 'General case' 0 C--O 1.214 -0.794 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -173.939 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -55.44 -43.9 75.8 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 177.612 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.439 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -87.14 -41.85 14.94 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 CA-C-O 121.518 0.675 . . . . 0.0 109.32 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.455 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.92 -38.08 81.32 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -174.64 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -67.62 -32.91 73.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.716 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -88.69 -7.38 56.42 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.671 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 84.9 m-20 -123.49 40.58 3.69 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.122 0.487 . . . . 0.0 111.017 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 12.0 p -62.63 -29.53 70.69 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.638 -0.664 . . . . 0.0 112.766 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -63.17 -29.21 70.61 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.527 0.68 . . . . 0.0 111.633 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.402 HG21 HD21 ' A' ' 475' ' ' LEU . 46.9 t -71.45 -43.79 72.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 43.1 t -61.95 -39.99 85.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.02 76.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.293 177.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.8 m -77.57 -38.55 48.17 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 118.883 0.765 . . . . 0.0 109.939 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.704 HD23 HD11 ' A' ' 526' ' ' ILE . 55.1 mt -58.66 -34.32 71.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.148 0.499 . . . . 0.0 110.208 177.443 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 5.4 mtpp -61.73 -34.36 75.68 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.008 -0.432 . . . . 0.0 111.66 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -69.71 -45.51 68.08 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.728 0.299 . . . . 0.0 111.769 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.704 HD11 HD23 ' A' ' 523' ' ' LEU . 3.9 pt -78.42 -22.59 13.29 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -175.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.469 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -64.36 -12.28 40.82 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 121.903 -0.498 . . . . 0.0 112.168 175.367 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -121.38 18.95 11.39 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 122.604 0.361 . . . . 0.0 111.51 175.121 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -67.92 118.4 11.07 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -176.789 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -85.19 -26.15 26.94 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -177.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.63 -41.59 98.24 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.174 0.511 . . . . 0.0 111.367 -175.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -130.93 109.92 10.89 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.82 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -58.18 -39.31 78.61 Favored 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.801 178.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -56.54 -42.79 79.09 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.385 0.612 . . . . 0.0 111.262 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 69.0 t -59.89 -44.06 93.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.801 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 29.3 ttm -57.98 -48.01 81.28 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 122.61 0.364 . . . . 0.0 110.4 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.68 -47.15 76.42 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -72.12 -37.31 69.5 Favored 'General case' 0 CA--C 1.513 -0.468 0 C-N-CA 118.148 -1.421 . . . . 0.0 110.778 -176.224 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 539' ' ' ALA . . . . . 0.405 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -59.11 -40.87 86.68 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 178.065 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.4 -49.92 71.89 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.04 -43.8 91.69 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 -178.823 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 65.1 t -69.18 -50.06 56.14 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.971 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.493 -176.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -54.31 -44.82 72.34 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.11 -0.329 . . . . 0.0 110.11 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.4 m -66.38 -36.22 82.31 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.914 0.486 . . . . 0.0 111.291 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 41.1 mtt-85 -60.47 -28.92 68.71 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.735 -0.603 . . . . 0.0 110.329 175.387 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.892 HD22 HG21 ' A' ' 508' ' ' VAL . 7.8 mt -76.77 -33.42 58.07 Favored 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -175.07 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -29.64 70.31 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.755 178.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.8 m -79.18 -14.31 59.16 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.173 176.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 71.9 mtt85 -104.54 -23.55 13.12 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -166.41 161.78 35.45 Favored Glycine 0 N--CA 1.453 -0.179 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 10.2 m . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.385 -0.817 . . . . 0.0 112.882 -177.006 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -75.17 171.34 14.33 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 176.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 24.9 m -69.96 145.14 93.88 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 177.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.5 150.87 75.67 Favored 'Trans proline' 0 C--O 1.238 0.524 0 C-N-CA 117.958 -0.895 . . . . 0.0 113.712 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.9 m -69.82 164.92 22.62 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.618 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.403 HG13 ' HB3' ' A' ' 506' ' ' LEU . 43.1 t -54.65 -48.02 72.15 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.14 0 O-C-N 122.042 -0.411 . . . . 0.0 111.824 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -60.25 -34.25 73.44 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -68.77 -42.89 76.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 122.166 0.984 . . . . 0.0 108.603 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -72.57 -34.84 67.75 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.332 -176.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.551 HD21 HG21 ' A' ' 519' ' ' VAL . 2.1 tt -57.0 -40.3 76.33 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.364 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -60.35 -37.18 79.87 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.59 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -68.72 -53.44 22.06 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.828 176.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -45.33 82.81 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 118.557 0.617 . . . . 0.0 112.191 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.426 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.4 t-160 -57.44 -43.78 84.18 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 48.7 m -64.63 -38.5 91.21 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.422 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 50.5 mm-40 -65.47 -35.8 81.97 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.046 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.4 -42.34 83.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.024 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -64.16 -45.25 89.29 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -65.13 -33.41 75.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.272 -178.207 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.83 -18.05 65.07 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 29.8 mt -108.56 12.08 26.26 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -177.537 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -54.49 129.69 36.94 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.8 t -62.94 -41.17 91.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 122.612 1.196 . . . . 0.0 107.819 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -65.63 -28.03 68.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.052 -1.886 . . . . 0.0 113.549 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 5.7 m -159.63 72.7 3.28 Favored Pre-proline 0 N--CA 1.473 0.691 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -176.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -73.4 143.01 34.18 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 114.281 -3.346 . . . . 0.0 112.509 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -137.22 100.44 4.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.581 0.705 . . . . 0.0 109.976 -178.155 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.7 -47.88 91.13 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.889 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -177.97 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -57.04 -32.05 65.78 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.9 ttt180 -68.84 -40.25 79.53 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 -177.476 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.4 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.85 -49.81 69.12 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 175.696 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 60.9 mt -56.54 -44.36 80.81 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -175.714 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -62.82 -39.95 95.87 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.716 0.769 . . . . 0.0 111.206 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.422 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -70.88 -45.68 63.97 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 121.745 -0.597 . . . . 0.0 110.0 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.4 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.58 -49.51 70.2 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.594 177.202 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -61.89 -36.06 80.16 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -175.672 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.38 -46.44 66.92 Favored 'General case' 0 C--O 1.223 -0.337 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.94 -33.64 67.2 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.498 0.666 . . . . 0.0 109.951 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.23 -17.53 68.27 Favored Glycine 0 N--CA 1.452 -0.288 0 N-CA-C 115.115 0.806 . . . . 0.0 115.115 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.2 t -111.87 -11.44 13.91 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.989 0.895 . . . . 0.0 110.241 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.403 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.2 mt -69.37 148.67 49.33 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 121.896 -0.503 . . . . 0.0 109.822 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.443 ' O ' HD13 ' A' ' 512' ' ' ILE . 35.7 tt0 -78.25 84.15 4.47 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-O 122.49 1.138 . . . . 0.0 108.864 177.299 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.926 HG21 HD22 ' A' ' 546' ' ' LEU . 27.2 m -98.55 47.22 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-O 123.21 1.481 . . . . 0.0 107.708 -178.971 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.3 t -66.8 171.93 4.82 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 -178.03 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.7 m -49.15 -33.69 12.65 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -173.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -55.62 -44.79 77.38 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 176.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 507' ' ' GLN . 3.9 mp -83.63 -42.48 17.48 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 CA-C-O 122.036 0.922 . . . . 0.0 108.611 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -37.7 76.56 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -176.26 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -67.11 -33.44 75.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.425 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -89.35 -9.74 49.27 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.248 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -125.08 41.7 3.45 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.516 0.674 . . . . 0.0 112.002 -175.973 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 22.8 p -62.24 -27.43 68.99 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -66.95 -26.54 66.88 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.551 HG21 HD21 ' A' ' 475' ' ' LEU . 43.0 t -71.71 -42.26 70.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.2 t -63.33 -37.35 79.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.57 -34.46 77.86 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.872 177.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.1 m -77.27 -39.84 46.72 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 118.072 0.396 . . . . 0.0 110.203 179.47 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 526' ' ' ILE . 54.1 mt -58.24 -35.37 71.61 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.082 0.467 . . . . 0.0 110.929 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -63.32 -29.01 70.4 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.062 -0.399 . . . . 0.0 111.348 175.219 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -74.58 -42.95 57.83 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.648 HD11 HD23 ' A' ' 523' ' ' LEU . 1.3 pt -78.78 -23.38 13.0 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.4 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -60.8 -17.13 47.63 Favored 'General case' 0 C--O 1.214 -0.784 0 O-C-N 121.994 -0.442 . . . . 0.0 111.955 176.406 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -118.68 19.13 13.3 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.01 0.524 . . . . 0.0 111.386 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -67.07 115.49 6.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.083 0.468 . . . . 0.0 111.992 -176.464 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -83.78 -21.99 32.0 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 -177.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -70.42 -22.45 62.72 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 120.527 -0.469 . . . . 0.0 112.119 -177.143 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -152.24 126.68 9.36 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.588 175.552 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.8 tptt -64.37 -47.8 77.9 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.555 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -57.75 -39.78 78.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.339 0.59 . . . . 0.0 111.347 -174.689 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 59.8 t -55.99 -45.15 80.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.121 176.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.2 ttp -65.87 -44.08 86.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.28 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.04 -46.69 80.2 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -69.43 -38.95 78.07 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.682 -0.807 . . . . 0.0 110.871 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.64 85.99 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.211 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.37 -50.98 65.56 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.439 -1.255 . . . . 0.0 113.361 179.516 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -42.13 89.53 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.55 -49.66 50.83 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.935 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.177 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -55.12 -44.82 75.37 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.5 m -66.4 -36.94 84.11 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 122.829 0.451 . . . . 0.0 110.997 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 5.7 mtt85 -58.32 -31.78 67.86 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.023 -0.423 . . . . 0.0 110.118 175.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.926 HD22 HG21 ' A' ' 508' ' ' VAL . 4.6 mt -76.64 -31.75 57.57 Favored 'General case' 0 CA--C 1.5 -0.958 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -176.392 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -38.86 92.59 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.153 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.2 m -69.82 -17.9 63.42 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 78.5 mtt85 -102.22 -0.66 32.7 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -99.78 -164.18 29.11 Favored Glycine 0 C--O 1.225 -0.424 0 N-CA-C 114.477 0.551 . . . . 0.0 114.477 -173.346 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 17.7 m . . . . . 0 C--O 1.243 0.728 0 C-N-CA 124.361 1.064 . . . . 0.0 112.174 -179.244 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 118.643 -0.694 . . . . 0.0 109.629 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 57.47 -159.82 0.25 Allowed 'General case' 0 CA--C 1.542 0.666 0 O-C-N 124.188 0.93 . . . . 0.0 109.967 -177.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 23.3 t -151.73 142.1 14.91 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.01 150.08 72.4 Favored 'Trans proline' 0 C--O 1.24 0.625 0 C-N-CA 117.615 -1.123 . . . . 0.0 113.497 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.9 m -69.4 167.8 15.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.645 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 41.1 t -55.87 -47.57 79.54 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.858 0 O-C-N 122.109 -0.37 . . . . 0.0 111.656 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.412 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.3 pt-20 -63.53 -33.95 76.71 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -67.73 -42.32 82.1 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -69.66 -33.25 72.32 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.63 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.16 -38.95 71.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.741 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -53.86 -39.53 65.73 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.855 -178.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -70.9 -55.43 8.46 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.34 -47.72 78.23 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.484 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -60.95 -40.31 92.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 64.6 m -64.85 -42.0 95.25 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.921 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -62.99 -41.79 99.66 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.03 178.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -54.41 -48.45 68.87 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.021 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.274 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -65.9 -40.51 91.6 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -176.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -68.88 -26.59 65.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.655 0.264 . . . . 0.0 111.004 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -72.5 -17.68 61.73 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 178.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 486' ' ' LEU . . . . . 0.421 HD11 ' CG2' ' A' ' 526' ' ' ILE . 25.0 mt -103.93 12.14 34.66 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -55.27 128.01 32.01 Favored 'General case' 0 C--O 1.21 -1.019 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 178.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 52.5 t -63.0 -40.46 89.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 122.117 0.96 . . . . 0.0 109.46 179.323 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -65.87 -31.64 72.69 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 113.981 -1.463 . . . . 0.0 112.691 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 17.2 t -159.8 78.19 2.76 Favored Pre-proline 0 C--O 1.246 0.877 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.799 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.29 148.73 44.18 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 115.832 -2.312 . . . . 0.0 112.153 178.299 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -137.32 97.72 3.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.61 0.719 . . . . 0.0 109.093 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.436 HG22 ' HB3' ' A' ' 532' ' ' ASN . 70.8 t -59.13 -42.85 87.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.676 -178.427 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -60.46 -35.64 76.35 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.492 0.587 . . . . 0.0 110.871 -177.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 40.7 ttm180 -65.1 -43.07 93.25 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.097 0.475 . . . . 0.0 109.933 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.467 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.3 OUTLIER -65.27 -50.39 65.94 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 177.584 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 86.7 mt -56.9 -42.29 79.63 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 111.357 0.132 . . . . 0.0 111.357 -176.101 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -65.62 -38.57 89.81 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.35 0.595 . . . . 0.0 111.67 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -66.57 -47.18 73.6 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 177.798 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.467 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -57.35 -42.71 82.55 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.605 177.685 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -64.77 -37.15 86.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 119.073 0.851 . . . . 0.0 112.541 -177.474 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -69.83 -45.01 68.76 Favored 'General case' 0 C--O 1.225 -0.219 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 177.775 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.76 -35.31 68.49 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.291 0.567 . . . . 0.0 110.927 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.94 -19.27 67.53 Favored Glycine 0 C--O 1.24 0.506 0 N-CA-C 114.928 0.731 . . . . 0.0 114.928 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.3 t -109.06 -16.28 14.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 117.582 0.691 . . . . 0.0 110.091 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.7 mt -65.03 144.16 57.47 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.348 0.594 . . . . 0.0 109.935 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.503 ' O ' HD13 ' A' ' 512' ' ' ILE . 47.4 mt-30 -78.12 84.52 4.35 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 122.01 0.91 . . . . 0.0 109.747 177.225 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.833 HG21 HD22 ' A' ' 546' ' ' LEU . 35.5 m -98.92 45.0 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-O 123.008 1.385 . . . . 0.0 108.03 179.723 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.45 173.69 3.16 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.148 -1.387 . . . . 0.0 107.691 -177.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.28 -32.44 10.88 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 -173.556 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.49 -45.11 77.04 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.503 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.66 -39.23 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 0 CA-C-O 121.2 0.524 . . . . 0.0 109.718 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -35.82 75.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -175.125 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -64.74 -32.81 74.66 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.567 0.698 . . . . 0.0 111.71 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -95.05 1.16 55.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.592 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -132.2 42.97 3.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.845 0.831 . . . . 0.0 111.917 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.0 p -65.22 -28.65 69.51 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 121.673 -0.642 . . . . 0.0 111.905 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -67.38 -26.21 66.35 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.547 0.689 . . . . 0.0 111.991 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 65.5 t -70.24 -43.86 78.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 178.381 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 44.0 t -62.49 -35.3 69.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 178.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.43 -39.88 94.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 119.018 -0.515 . . . . 0.0 111.203 177.102 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 99.3 m -73.57 -39.15 64.87 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 119.33 0.968 . . . . 0.0 109.911 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.672 HD23 HD11 ' A' ' 526' ' ' ILE . 62.7 mt -57.87 -35.31 70.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.791 0.329 . . . . 0.0 111.09 178.677 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -65.35 -29.04 69.73 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.751 -0.593 . . . . 0.0 111.548 175.702 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -73.15 -44.63 59.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.021 0.438 . . . . 0.0 110.631 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.672 HD11 HD23 ' A' ' 523' ' ' LEU . 14.7 pt -78.26 -24.48 13.76 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.847 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -175.654 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.499 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -59.26 -19.37 45.4 Favored 'General case' 0 C--O 1.213 -0.833 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 176.039 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -118.67 19.12 13.31 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 122.911 0.484 . . . . 0.0 111.784 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.401 ' HB2' ' HA ' ' A' ' 526' ' ' ILE . 7.9 t80 -73.19 104.62 4.31 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.232 0.539 . . . . 0.0 111.624 -176.389 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -68.32 -32.33 72.37 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 116.419 2.007 . . . . 0.0 116.419 -175.455 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.68 -44.33 94.05 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 122.195 0.998 . . . . 0.0 112.007 -176.551 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 532' ' ' ASN . . . . . 0.436 ' HB3' HG22 ' A' ' 493' ' ' VAL . 67.1 m-20 -113.99 90.34 3.32 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 -174.187 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -53.22 -50.0 65.63 Favored 'General case' 0 C--O 1.207 -1.163 0 O-C-N 122.33 -0.231 . . . . 0.0 110.958 -179.143 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -58.9 -37.74 77.3 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.845 0.355 . . . . 0.0 111.625 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 535' ' ' VAL . . . . . 0.416 HG23 HG13 ' A' ' 493' ' ' VAL . 42.7 t -57.62 -44.41 85.3 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.559 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.322 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -63.93 -44.94 91.38 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.53 -47.67 80.69 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -70.44 -40.24 73.89 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 119.552 -0.859 . . . . 0.0 110.648 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.89 -40.02 87.32 Favored 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.499 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -61.01 -49.41 77.51 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 178.062 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -44.31 95.66 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.44 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.54 -51.45 51.54 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.774 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.059 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -53.93 -46.2 71.46 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 122.787 0.435 . . . . 0.0 110.27 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 33.2 m -63.29 -38.96 93.21 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 122.966 0.506 . . . . 0.0 110.982 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -62.21 -29.75 70.6 Favored 'General case' 0 C--O 1.215 -0.734 0 O-C-N 121.69 -0.631 . . . . 0.0 110.803 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.833 HD22 HG21 ' A' ' 508' ' ' VAL . 5.2 mt -75.12 -30.73 60.92 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 -178.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -34.37 77.94 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.712 177.252 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.0 m -81.45 -12.19 58.98 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 177.357 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -97.55 -11.27 23.9 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 122.247 -0.283 . . . . 0.0 110.62 177.64 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -106.2 -177.64 23.48 Favored Glycine 0 C--O 1.225 -0.444 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 -176.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 29.5 m . . . . . 0 C--O 1.246 0.894 0 O-C-N 124.967 1.039 . . . . 0.0 109.682 -177.029 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -72.77 155.66 39.72 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.308 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 45.9 m -79.97 128.97 72.06 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -70.82 153.04 64.25 Favored 'Trans proline' 0 C--O 1.239 0.574 0 C-N-CA 117.914 -0.924 . . . . 0.0 113.224 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.9 m -67.96 164.01 20.88 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.189 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.445 HG13 ' HB3' ' A' ' 506' ' ' LEU . 38.0 t -54.17 -48.99 65.31 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.878 0 O-C-N 122.027 -0.421 . . . . 0.0 111.997 179.358 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.41 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.2 pt-20 -61.26 -34.2 74.78 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -178.891 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -67.47 -41.77 84.07 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -72.51 -35.47 68.12 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.942 -177.665 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.553 HD21 HG21 ' A' ' 519' ' ' VAL . 3.8 tt -58.29 -37.83 75.82 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.578 178.623 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -57.73 -41.87 82.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 118.593 0.633 . . . . 0.0 110.293 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -67.53 -53.17 30.79 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 120.378 -0.529 . . . . 0.0 110.089 178.478 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -44.7 86.47 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.658 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.434 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.9 t-160 -58.31 -43.85 88.35 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -179.034 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.9 m -63.77 -37.66 88.19 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -65.78 -37.66 86.91 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.193 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -58.08 -45.51 88.35 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.115 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 24.4 mmtt -61.11 -45.63 93.9 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -64.17 -34.51 78.23 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.715 0.293 . . . . 0.0 110.639 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.73 -16.54 64.18 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.488 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.9 mt -109.99 12.11 23.8 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -56.78 130.62 46.39 Favored 'General case' 0 C--O 1.21 -1.024 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 46.2 t -62.5 -40.93 89.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 122.303 1.049 . . . . 0.0 108.863 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -67.19 -30.19 70.07 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.638 -1.619 . . . . 0.0 113.093 -178.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.6 t -160.93 76.4 2.53 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -175.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -75.54 146.46 30.81 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 116.896 -1.603 . . . . 0.0 113.053 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -137.21 99.96 4.13 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.447 0.641 . . . . 0.0 110.354 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.3 -46.17 81.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.781 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -58.43 -32.68 68.92 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 121.935 0.874 . . . . 0.0 109.773 -176.558 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -70.76 -39.87 73.01 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.325 -1.307 . . . . 0.0 108.835 -175.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.409 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -66.01 -50.14 65.29 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 175.243 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 79.2 mt -56.62 -43.09 79.88 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -175.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.74 -38.38 90.81 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.619 0.723 . . . . 0.0 111.868 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -71.24 -45.24 63.69 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 121.655 -0.653 . . . . 0.0 109.617 178.45 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.409 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -55.04 -48.14 73.82 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.804 177.243 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -62.33 -35.64 79.71 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -175.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -67.41 -49.4 63.96 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.96 -33.51 62.42 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.393 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.95 -18.52 70.78 Favored Glycine 0 C--O 1.24 0.471 0 N-CA-C 115.176 0.831 . . . . 0.0 115.176 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.5 t -109.95 -13.36 14.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 118.085 0.942 . . . . 0.0 110.225 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.445 ' HB3' HG13 ' A' ' 471' ' ' VAL . 5.2 mt -67.02 146.85 53.92 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 122.021 -0.424 . . . . 0.0 110.949 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.469 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.4 tt0 -78.65 84.43 4.75 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-O 122.544 1.164 . . . . 0.0 109.103 177.213 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.913 HG21 HD22 ' A' ' 546' ' ' LEU . 27.0 m -98.82 47.39 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-O 122.968 1.366 . . . . 0.0 108.708 -178.258 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.8 t -66.78 172.34 4.42 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 106.824 -1.546 . . . . 0.0 106.824 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.0 m -49.17 -32.87 11.06 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -173.705 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -55.39 -44.81 76.49 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.469 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -85.75 -41.83 15.63 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.448 0 CA-C-O 121.774 0.797 . . . . 0.0 109.231 179.029 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.484 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.69 -37.51 79.04 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -175.387 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -65.39 -31.98 73.38 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.604 0.716 . . . . 0.0 112.203 -178.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -93.72 -6.12 46.89 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.085 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -127.93 39.97 3.76 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.533 0.682 . . . . 0.0 111.819 -178.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 28.2 p -63.8 -24.83 67.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -61.83 -32.54 72.87 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.475 0.655 . . . . 0.0 112.313 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.553 HG21 HD21 ' A' ' 475' ' ' LEU . 21.3 t -71.32 -40.99 74.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 31.7 t -62.86 -38.36 81.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.655 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.42 -30.2 71.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.948 177.845 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.6 m -82.58 -39.26 22.51 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.48 HD23 HD11 ' A' ' 526' ' ' ILE . 31.9 mt -57.56 -36.53 71.79 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.285 0.564 . . . . 0.0 110.881 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -62.44 -28.55 69.88 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 122.165 -0.335 . . . . 0.0 111.536 175.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -76.96 -42.18 40.12 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 178.227 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.48 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -78.76 -22.23 12.95 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.106 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -177.303 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.432 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -60.52 -18.12 50.02 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 122.431 0.292 . . . . 0.0 111.547 175.674 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -118.67 19.38 13.22 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.198 0.599 . . . . 0.0 111.571 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -66.64 110.35 3.18 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.195 0.521 . . . . 0.0 112.187 -176.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -74.39 -28.05 60.92 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.15 -41.67 94.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -175.468 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -131.94 111.05 11.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 -178.244 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -55.58 -44.24 76.73 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.045 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -55.9 -42.74 76.45 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.004 0.431 . . . . 0.0 112.058 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -57.56 -44.38 84.97 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -62.83 -44.49 96.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.063 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.25 -46.89 78.74 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.3 tptt -69.04 -39.66 79.07 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 119.1 -1.04 . . . . 0.0 111.071 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.72 -40.26 87.4 Favored 'General case' 0 C--O 1.212 -0.87 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.426 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.432 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.42 -50.44 71.49 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.287 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -45.5 89.72 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 60.6 t -67.11 -49.57 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.979 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.202 -177.084 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -56.01 -44.98 79.21 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 26.6 m -66.12 -35.63 81.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.295 0.569 . . . . 0.0 111.161 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 54.2 mtt-85 -61.27 -27.81 68.74 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 121.705 -0.622 . . . . 0.0 110.469 175.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.913 HD22 HG21 ' A' ' 508' ' ' VAL . 9.9 mt -76.48 -35.78 58.22 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -176.516 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -28.01 69.71 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 114.735 -1.121 . . . . 0.0 111.432 178.32 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.6 m -79.16 -8.69 59.2 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.662 178.137 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 73.0 mtt85 -117.64 -21.91 8.31 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -162.5 167.23 36.94 Favored Glycine 0 C--O 1.237 0.317 0 C-N-CA 121.342 -0.456 . . . . 0.0 112.187 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 8.7 m . . . . . 0 C--O 1.248 0.993 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -176.695 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -72.84 162.36 29.58 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 176.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.9 p -143.33 150.23 50.94 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 178.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.85 152.3 73.8 Favored 'Trans proline' 0 C--O 1.236 0.423 0 N-CA-C 113.839 0.669 . . . . 0.0 113.839 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.8 m -71.18 166.19 22.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.557 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 39.3 t -53.76 -48.41 61.25 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.05 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -63.16 -34.21 77.13 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -178.34 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.69 -39.92 88.32 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 179.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -74.16 -35.79 64.05 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.214 -178.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.555 HD21 HG21 ' A' ' 519' ' ' VAL . 5.2 tt -58.63 -38.68 78.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.047 -0.978 . . . . 0.0 109.332 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -55.21 -40.32 70.66 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -71.8 -53.61 12.81 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.27 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -45.84 79.47 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -178.32 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.45 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.9 t-160 -59.13 -41.94 89.44 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -179.585 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.5 m -65.21 -40.02 93.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 119.441 -0.314 . . . . 0.0 111.196 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.5 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 50.5 mm-40 -65.02 -40.51 94.98 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.368 178.751 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.9 mt -54.29 -48.5 67.35 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.06 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -65.89 -38.36 88.55 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -177.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -66.84 -32.35 73.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.664 0.269 . . . . 0.0 110.299 177.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -20.42 66.0 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.9 mt -101.15 12.05 38.32 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 12.6 mtpp -56.72 122.22 11.62 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 40.1 t -60.98 -39.04 80.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 122.481 1.134 . . . . 0.0 109.4 178.727 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -64.26 -28.21 69.57 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 113.525 -1.67 . . . . 0.0 112.811 -178.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -168.73 81.13 0.74 Allowed Pre-proline 0 N--CA 1.47 0.538 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.13 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.87 149.44 33.28 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 118.083 -0.811 . . . . 0.0 113.182 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -137.28 99.23 3.92 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.526 0.679 . . . . 0.0 110.871 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.96 -45.36 87.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -179.192 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -58.79 -32.13 69.05 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -69.49 -40.28 77.12 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.431 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.99 -49.92 66.1 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 176.053 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.64 -43.97 80.83 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -176.002 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -63.5 -37.45 87.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.565 0.698 . . . . 0.0 111.447 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.5 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -70.48 -47.49 60.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.365 0.603 . . . . 0.0 109.601 178.076 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.431 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.65 -49.01 71.61 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.227 178.021 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -61.73 -35.37 77.87 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -175.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -47.86 57.89 Favored 'General case' 0 C--O 1.224 -0.266 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 176.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.7 -34.02 67.04 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.401 0.62 . . . . 0.0 110.197 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.94 -17.89 68.09 Favored Glycine 0 C--O 1.236 0.259 0 N-CA-C 115.292 0.877 . . . . 0.0 115.292 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.9 t -110.86 -11.31 14.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 118.003 0.901 . . . . 0.0 110.235 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.7 mt -68.85 148.87 49.62 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 121.939 -0.475 . . . . 0.0 110.296 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.445 ' O ' HD13 ' A' ' 512' ' ' ILE . 26.5 tt0 -77.28 84.48 3.72 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 122.719 1.247 . . . . 0.0 109.087 177.507 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.901 HG21 HD22 ' A' ' 546' ' ' LEU . 31.1 m -100.28 50.18 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 CA-C-O 122.969 1.366 . . . . 0.0 108.167 -178.188 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.1 t -66.53 171.87 4.64 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.398 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 40.4 m -49.32 -31.49 9.27 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -175.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -55.43 -45.08 76.8 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.445 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.1 mp -86.05 -42.88 16.19 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -37.98 81.82 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -175.307 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -69.23 -30.29 68.41 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.219 -178.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -89.16 -5.24 57.88 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 122.187 -0.321 . . . . 0.0 110.901 177.986 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -129.87 43.95 3.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.591 0.71 . . . . 0.0 112.426 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.8 p -63.66 -25.27 68.14 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.08 -31.61 72.91 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.001 0.905 . . . . 0.0 111.922 178.539 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.555 HG21 HD21 ' A' ' 475' ' ' LEU . 57.8 t -69.53 -42.84 80.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 26.5 t -62.72 -38.07 80.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.93 -39.05 93.41 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.334 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 92.6 m -73.68 -38.08 65.03 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 118.483 0.583 . . . . 0.0 110.464 -178.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.66 HD23 HD11 ' A' ' 526' ' ' ILE . 63.1 mt -58.7 -35.75 73.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.136 0.493 . . . . 0.0 110.593 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -65.77 -29.14 69.6 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.878 -0.514 . . . . 0.0 111.357 175.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -72.22 -45.51 59.97 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.915 0.388 . . . . 0.0 110.808 178.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.66 HD11 HD23 ' A' ' 523' ' ' LEU . 16.6 pt -78.75 -20.61 12.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.806 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 -176.592 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.428 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.4 OUTLIER -62.45 -17.56 59.69 Favored 'General case' 0 C--O 1.213 -0.864 0 O-C-N 121.783 -0.573 . . . . 0.0 111.897 176.022 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.7 19.35 13.21 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.217 0.607 . . . . 0.0 111.411 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -65.5 114.65 5.03 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.024 0.44 . . . . 0.0 111.943 -177.334 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -75.2 -29.92 60.48 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.45 -40.72 96.26 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -132.57 112.1 11.79 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.23 -178.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 40.2 tptt -56.67 -43.69 80.64 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.388 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -55.74 -43.27 76.46 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.189 0.441 . . . . 0.0 112.189 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 67.4 t -57.35 -44.51 84.35 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -63.85 -43.53 95.85 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.99 -47.94 75.74 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.858 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -69.28 -38.98 78.6 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 118.864 -1.134 . . . . 0.0 110.586 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 539' ' ' ALA . . . . . 0.402 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -59.37 -41.26 88.88 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-O 121.442 0.639 . . . . 0.0 109.498 178.827 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.428 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.91 -48.25 77.34 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.913 -1.04 . . . . 0.0 112.924 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -41.51 92.58 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 52.8 t -70.6 -51.25 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.286 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -54.63 -45.9 73.83 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 122.499 0.32 . . . . 0.0 110.278 -177.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 16.0 m -65.78 -34.61 78.56 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.289 0.566 . . . . 0.0 111.197 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.01 -28.76 70.32 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 121.803 -0.561 . . . . 0.0 109.966 175.396 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.901 HD22 HG21 ' A' ' 508' ' ' VAL . 9.1 mt -76.57 -33.33 58.49 Favored 'General case' 0 C--O 1.207 -1.143 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 -176.53 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -27.28 69.15 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.208 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.5 m -79.13 -8.51 59.04 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.866 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 69.0 mtt85 -117.99 -26.05 6.54 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -162.11 165.71 36.04 Favored Glycine 0 C--O 1.237 0.297 0 N-CA-C 112.302 -0.319 . . . . 0.0 112.302 -177.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 9.2 m . . . . . 0 C--O 1.241 0.655 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -176.837 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 118.523 -0.751 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 53.4 35.05 19.47 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 124.022 0.826 . . . . 0.0 110.209 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 56.0 p -135.67 67.43 65.29 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.438 -174.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.4 149.76 63.32 Favored 'Trans proline' 0 C--O 1.243 0.762 0 C-N-CA 117.223 -1.385 . . . . 0.0 113.777 -178.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.7 m -71.45 168.17 18.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.184 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 51.7 t -55.86 -46.77 80.21 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 CA-C-O 120.879 0.371 . . . . 0.0 111.626 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.9 OUTLIER -65.92 -34.1 77.36 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.894 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -67.92 -40.86 83.33 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 176.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -69.14 -34.66 75.37 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.035 -178.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -56.09 -39.9 72.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.398 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -53.4 -39.7 64.51 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.995 -178.721 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -70.69 -56.49 6.29 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.619 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -45.8 86.04 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -176.118 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -59.49 -42.65 92.61 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 58.5 m -63.59 -38.45 91.17 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.075 0.234 . . . . 0.0 111.306 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.407 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 10.8 mm-40 -64.25 -38.25 90.39 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.649 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 92.5 mt -59.93 -41.73 87.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.088 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 51.6 mmtt -64.5 -45.22 88.2 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 121.832 -0.543 . . . . 0.0 112.068 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -65.77 -32.17 73.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.712 0.292 . . . . 0.0 110.794 -178.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.63 -16.97 64.58 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 178.627 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 34.5 mt -111.21 12.3 21.8 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -177.214 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -54.19 133.33 44.38 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 177.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 63.5 t -63.81 -42.32 95.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 122.264 1.031 . . . . 0.0 108.393 176.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -68.29 -28.32 67.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.735 -1.575 . . . . 0.0 113.597 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 20.3 m -157.59 73.53 4.25 Favored Pre-proline 0 N--CA 1.472 0.645 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -72.25 143.37 39.38 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 115.194 -2.737 . . . . 0.0 112.204 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -137.28 100.65 4.31 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.689 0.756 . . . . 0.0 110.563 -178.714 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -47.28 91.58 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.867 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.943 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -57.59 -31.85 66.59 Favored 'General case' 0 CA--C 1.506 -0.716 0 O-C-N 123.301 0.376 . . . . 0.0 110.04 -177.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -70.88 -39.4 72.87 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -177.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.1 -48.96 69.2 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.434 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.86 -42.38 79.65 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.489 0.185 . . . . 0.0 111.314 -175.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -67.01 -36.8 82.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.44 0.638 . . . . 0.0 112.125 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.407 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.78 -45.86 67.05 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.411 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.45 -44.1 80.14 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.746 -1.116 . . . . 0.0 111.086 178.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -63.41 -37.39 87.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 119.156 0.889 . . . . 0.0 112.616 -177.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -70.51 -44.84 66.76 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 177.608 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.31 -35.79 67.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.237 0.541 . . . . 0.0 111.323 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.62 -20.35 69.95 Favored Glycine 0 C--O 1.24 0.506 0 N-CA-C 114.779 0.671 . . . . 0.0 114.779 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.2 t -107.14 -16.01 14.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 117.338 0.569 . . . . 0.0 110.081 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -65.47 145.53 56.01 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.095 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.474 ' O ' HD13 ' A' ' 512' ' ' ILE . 28.2 tt0 -80.09 79.59 6.62 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-O 122.542 1.163 . . . . 0.0 109.167 178.21 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.827 HG21 HD22 ' A' ' 546' ' ' LEU . 29.6 m -94.07 47.18 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 CA-C-O 122.991 1.377 . . . . 0.0 107.628 179.426 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.21 173.69 3.02 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 -178.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 13.8 m -48.32 -34.98 11.44 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 -173.425 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -54.86 -44.19 73.79 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 177.728 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.474 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -87.68 -38.74 12.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.418 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.84 -36.75 79.91 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -175.885 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -65.88 -32.29 73.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.385 0.612 . . . . 0.0 111.983 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -93.24 -1.64 55.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.493 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -129.46 44.94 2.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.815 0.817 . . . . 0.0 112.099 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 23.7 p -65.51 -28.18 69.01 Favored 'General case' 0 C--N 1.32 -0.678 0 O-C-N 121.746 -0.596 . . . . 0.0 112.132 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -66.74 -27.21 67.43 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.663 0.744 . . . . 0.0 111.838 177.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.7 t -70.72 -43.6 77.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.8 t -63.53 -37.17 78.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.32 -33.71 76.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.918 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 80.1 m -78.69 -40.27 34.34 Favored 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.547 HD23 HD11 ' A' ' 526' ' ' ILE . 40.2 mt -57.61 -35.4 70.4 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.124 0.488 . . . . 0.0 110.933 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.04 -26.92 68.78 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.895 -0.503 . . . . 0.0 111.886 175.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -76.47 -43.38 40.1 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.547 HD11 HD23 ' A' ' 523' ' ' LEU . 1.2 pt -78.81 -22.08 12.9 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.988 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -177.33 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.468 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -64.49 -12.1 40.63 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 175.317 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -121.14 19.32 11.56 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.821 0.448 . . . . 0.0 110.474 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.7 112.78 3.0 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.494 0.664 . . . . 0.0 112.497 -174.419 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -78.37 -31.42 48.48 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.55 -26.96 65.68 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -175.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.6 122.35 10.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.164 0.507 . . . . 0.0 112.354 176.933 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -64.15 -40.4 96.07 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -61.85 -40.86 96.82 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.552 0.692 . . . . 0.0 109.986 -176.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.3 t -58.03 -43.21 84.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.089 176.996 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 32.5 ttm -59.73 -48.64 80.85 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-O 120.8 0.333 . . . . 0.0 110.852 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -68.14 -45.72 72.82 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -178.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 44.7 tptt -69.51 -38.5 77.61 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 118.931 -1.107 . . . . 0.0 110.482 -177.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -60.13 -38.93 84.54 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.922 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.468 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.62 -48.91 70.65 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.716 -1.129 . . . . 0.0 113.981 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -40.5 87.79 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 61.9 t -70.59 -53.02 24.16 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.867 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.563 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -53.8 -45.1 70.63 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 122.372 0.269 . . . . 0.0 111.22 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 25.3 m -65.05 -36.98 86.08 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.171 0.588 . . . . 0.0 111.157 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 37.2 mtt85 -62.08 -29.96 70.67 Favored 'General case' 0 C--O 1.216 -0.674 0 O-C-N 121.563 -0.711 . . . . 0.0 110.59 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.827 HD22 HG21 ' A' ' 508' ' ' VAL . 4.7 mt -76.38 -31.12 57.82 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -175.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -42.49 99.17 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 175.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 18.0 m -68.63 -24.16 64.52 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 178.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -89.64 -4.72 57.65 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 122.194 -0.316 . . . . 0.0 111.011 177.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -134.59 48.95 0.92 Allowed Glycine 0 CA--C 1.51 -0.221 0 N-CA-C 112.029 -0.428 . . . . 0.0 112.029 -175.092 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 66.9 m . . . . . 0 C--O 1.253 1.27 0 N-CA-C 103.162 -2.903 . . . . 0.0 103.162 177.893 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -73.58 160.64 31.34 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 176.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 28.6 m -75.31 141.95 74.42 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 176.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -68.42 150.88 76.06 Favored 'Trans proline' 0 C--O 1.238 0.524 0 C-N-CA 117.928 -0.914 . . . . 0.0 113.5 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.6 m -70.04 164.57 23.72 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.798 -179.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 41.1 t -53.63 -46.09 60.67 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.947 0 O-C-N 122.016 -0.427 . . . . 0.0 112.103 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.03 -34.14 77.73 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.85 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -67.54 -40.2 85.03 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -73.07 -32.72 65.21 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.228 -177.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.419 HD23 HD21 ' A' ' 503' ' ' LEU . 1.9 tm? -57.43 -39.34 76.02 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.062 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -53.2 -39.83 63.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.87 0.304 . . . . 0.0 110.268 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -71.72 -57.28 4.51 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.866 177.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.79 -45.88 78.12 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -176.858 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -59.31 -42.01 90.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.9 m -65.14 -37.78 88.51 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 123.13 0.268 . . . . 0.0 111.476 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.49 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 46.5 mm-40 -64.74 -37.05 86.3 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.961 -0.695 . . . . 0.0 110.279 178.745 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -59.1 -42.58 86.99 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.063 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -62.51 -46.87 86.46 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -65.35 -33.13 75.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.89 0.376 . . . . 0.0 111.224 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.01 -17.32 64.61 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.6 mt -110.48 12.0 22.99 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -176.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -55.3 130.06 40.89 Favored 'General case' 0 C--O 1.208 -1.094 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 177.557 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 51.0 t -63.01 -40.49 89.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 122.267 1.032 . . . . 0.0 108.88 178.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.17 -29.87 69.68 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.756 -1.565 . . . . 0.0 113.011 -178.763 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 18.1 t -161.45 78.97 2.16 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.56 146.17 34.27 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 118.11 -0.794 . . . . 0.0 112.767 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -137.28 101.17 4.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.679 0.752 . . . . 0.0 110.804 -179.534 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.407 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.7 OUTLIER -60.05 -45.26 95.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -179.149 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -61.76 -31.08 71.25 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -69.19 -41.3 77.33 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -178.075 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.433 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -65.0 -48.29 74.48 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.004 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 73.7 mt -56.69 -44.96 82.01 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 19.4 t-20 -62.18 -41.0 97.93 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.799 0.809 . . . . 0.0 110.053 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.49 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.11 -48.16 68.97 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.339 0.59 . . . . 0.0 109.847 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.433 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.5 -45.76 84.54 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.379 178.944 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -63.25 -35.37 80.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 119.006 0.821 . . . . 0.0 112.475 -176.366 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -71.82 -43.8 64.98 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 177.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.419 HD21 HD23 ' A' ' 475' ' ' LEU . 0.2 OUTLIER -56.18 -33.86 65.67 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.511 0.672 . . . . 0.0 110.657 177.736 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.1 -16.42 66.6 Favored Glycine 0 C--O 1.239 0.411 0 CA-C-O 119.204 -0.775 . . . . 0.0 114.526 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.8 t -113.9 -14.3 12.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 118.042 0.921 . . . . 0.0 110.889 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.5 mt -66.48 145.97 55.06 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.877 -0.514 . . . . 0.0 109.829 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.416 ' O ' HD13 ' A' ' 512' ' ' ILE . 30.0 tt0 -79.11 84.42 5.09 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 122.836 1.303 . . . . 0.0 109.566 178.005 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.975 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -96.59 48.76 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-O 123.18 1.467 . . . . 0.0 107.996 -178.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.5 t -66.84 172.23 4.57 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 -178.17 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 2.7 m -49.26 -34.88 16.19 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -173.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -54.72 -44.63 73.67 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 177.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -86.12 -41.66 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.43 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.63 -38.86 82.51 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -175.32 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -69.33 -31.94 70.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.824 -177.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -88.42 -3.96 58.73 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.232 177.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -127.52 45.34 2.75 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.858 0.837 . . . . 0.0 112.465 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 17.5 p -64.91 -28.71 69.72 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 121.699 -0.626 . . . . 0.0 112.568 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -69.7 -22.5 63.41 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.503 0.668 . . . . 0.0 112.09 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 87.9 t -71.55 -45.17 69.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 177.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 50.6 t -62.94 -36.79 77.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.553 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.57 79.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.407 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.1 m -77.63 -39.08 46.42 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 118.47 0.577 . . . . 0.0 109.698 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.687 HD23 HD11 ' A' ' 526' ' ' ILE . 48.8 mt -59.11 -31.89 69.34 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.064 0.459 . . . . 0.0 111.464 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -64.73 -29.11 70.08 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.757 -0.589 . . . . 0.0 111.199 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -74.58 -42.59 58.46 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.687 HD11 HD23 ' A' ' 523' ' ' LEU . 1.3 pt -78.8 -22.42 12.92 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.905 0 N-CA-C 114.919 1.452 . . . . 0.0 114.919 -176.518 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.436 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -60.92 -18.8 58.83 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-O 120.845 0.355 . . . . 0.0 111.649 176.151 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -118.85 19.51 13.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.18 0.592 . . . . 0.0 111.508 178.648 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.403 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 14.0 t80 -66.8 118.48 10.38 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 122.661 0.384 . . . . 0.0 111.168 -178.509 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 44.1 mttp -83.13 -26.24 31.16 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 116.003 1.853 . . . . 0.0 116.003 -176.943 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.403 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -64.03 -40.57 96.62 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.614 -0.435 . . . . 0.0 111.564 -175.588 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -133.02 116.2 16.09 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.189 -178.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.9 tptt -57.48 -43.44 84.09 Favored 'General case' 0 C--O 1.21 -1.003 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -52.3 -45.91 65.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.077 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.8 t -58.52 -44.08 88.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.2 ttp -64.17 -44.31 92.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.32 -48.43 78.05 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.849 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.0 tptt -71.67 -38.62 70.63 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 118.315 -1.354 . . . . 0.0 111.961 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.04 -40.04 79.9 Favored 'General case' 0 C--O 1.212 -0.899 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.64 -51.07 68.7 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.09 178.325 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.59 -43.6 89.56 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 60.3 t -67.86 -51.27 51.8 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.809 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.233 -177.345 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -54.67 -44.87 73.7 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.653 0.263 . . . . 0.0 110.41 -177.488 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 40.5 m -63.81 -38.6 91.72 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 123.641 0.776 . . . . 0.0 111.315 179.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 66.2 mtt180 -61.69 -28.58 69.5 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 121.62 -0.675 . . . . 0.0 111.061 176.285 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.975 HD22 HG21 ' A' ' 508' ' ' VAL . 5.8 mt -76.52 -31.83 57.89 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 -176.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.25 -38.58 87.21 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.239 177.194 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 16.0 m -74.26 -19.03 60.64 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 67.2 mtt85 -99.33 -10.01 22.85 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -107.36 -169.73 22.05 Favored Glycine 0 C--O 1.227 -0.335 0 CA-C-O 119.802 -0.443 . . . . 0.0 113.476 -174.859 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.48 1.051 0 C-N-CA 126.057 1.743 . . . . 0.0 109.919 -179.4 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -68.81 150.64 47.6 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 176.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.5 m -150.97 152.86 32.35 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.02 148.71 70.44 Favored 'Trans proline' 0 C--O 1.238 0.51 0 C-N-CA 117.626 -1.116 . . . . 0.0 113.017 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.9 m -67.95 163.72 21.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.403 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.454 HG13 ' HB3' ' A' ' 506' ' ' LEU . 44.4 t -54.84 -46.92 75.43 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.049 0 O-C-N 122.047 -0.408 . . . . 0.0 111.539 179.502 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.439 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.5 pt-20 -61.03 -34.21 74.5 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -68.19 -41.42 81.44 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.15 0.976 . . . . 0.0 108.453 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -73.32 -34.89 65.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.927 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.563 HD21 HG21 ' A' ' 519' ' ' VAL . 2.6 tt -57.57 -37.99 74.09 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.663 178.355 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.36 -38.65 80.97 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.286 -0.565 . . . . 0.0 110.205 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -68.44 -53.34 24.24 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 176.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.27 -45.77 87.25 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.423 ' CG ' HG22 ' A' ' 519' ' ' VAL . 17.6 t-160 -58.8 -42.84 90.05 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 65.7 m -63.59 -41.71 98.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 119.573 -0.251 . . . . 0.0 111.195 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.442 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 60.9 mm-40 -63.79 -40.84 97.63 Favored 'General case' 0 CA--C 1.501 -0.92 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.28 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.54 -45.8 71.29 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.039 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -68.08 -39.13 82.99 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -67.75 -31.38 71.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.998 0.428 . . . . 0.0 110.408 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.06 -18.61 64.72 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 122.633 0.373 . . . . 0.0 111.807 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 27.0 mt -107.39 12.16 28.27 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -54.91 129.77 38.79 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.0 t -61.25 -40.08 84.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 122.474 1.13 . . . . 0.0 108.852 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -66.33 -28.76 68.92 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 113.398 -1.728 . . . . 0.0 112.676 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 22.9 t -159.59 76.99 2.95 Favored Pre-proline 0 C--O 1.24 0.577 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -73.43 141.61 31.91 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 114.979 -2.881 . . . . 0.0 112.29 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -137.27 105.1 5.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.491 0.662 . . . . 0.0 110.444 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.81 -44.18 96.99 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -58.71 -32.69 69.41 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -178.388 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 22.7 ttp180 -68.51 -41.0 80.59 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.429 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -68.0 -48.98 64.27 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.624 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.89 -44.07 81.95 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -61.91 -38.22 87.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.654 0.74 . . . . 0.0 111.704 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.442 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -70.93 -47.46 58.93 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.499 0.666 . . . . 0.0 109.704 178.382 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.429 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.93 -47.89 73.83 Favored 'General case' 0 N--CA 1.428 -1.537 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.115 178.743 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -61.4 -35.74 78.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.434 0.902 . . . . 0.0 113.434 -175.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.65 -46.13 59.93 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.49 -33.87 68.48 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.337 0.589 . . . . 0.0 109.872 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.64 -16.65 68.05 Favored Glycine 0 C--O 1.239 0.429 0 N-CA-C 115.034 0.774 . . . . 0.0 115.034 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.4 t -112.76 -7.93 13.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 118.136 0.968 . . . . 0.0 111.017 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.454 ' HB3' HG13 ' A' ' 471' ' ' VAL . 3.7 mt -71.89 148.93 45.62 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.424 ' O ' HD13 ' A' ' 512' ' ' ILE . 26.1 tt0 -79.4 84.33 5.32 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 122.757 1.265 . . . . 0.0 109.452 178.027 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.889 HG21 HD22 ' A' ' 546' ' ' LEU . 30.2 m -98.3 48.3 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 CA-C-O 123.028 1.394 . . . . 0.0 107.93 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.0 t -66.24 172.44 3.89 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 -178.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 20.2 m -49.32 -33.25 12.84 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -174.166 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -55.48 -44.35 76.4 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 178.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.424 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -86.63 -41.4 14.89 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 CA-C-O 121.502 0.668 . . . . 0.0 109.348 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.455 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.35 -38.47 80.48 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -176.054 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -63.85 -31.37 72.52 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.641 0.734 . . . . 0.0 112.446 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -95.38 -5.87 42.29 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.447 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -127.91 39.25 3.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.465 0.65 . . . . 0.0 111.296 -178.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.8 p -62.56 -25.48 68.08 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -178.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.36 -31.78 73.02 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.424 0.631 . . . . 0.0 112.155 178.211 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.563 HG21 HD21 ' A' ' 475' ' ' LEU . 41.3 t -71.15 -40.87 75.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.4 t -62.5 -37.75 79.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 178.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.69 92.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.38 177.191 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.5 m -73.68 -37.99 65.05 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 118.383 0.538 . . . . 0.0 110.536 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.686 HD23 HD11 ' A' ' 526' ' ' ILE . 68.6 mt -59.36 -34.51 72.49 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.929 0.395 . . . . 0.0 110.815 178.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -65.57 -29.04 69.6 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.807 -0.558 . . . . 0.0 111.212 175.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -71.21 -45.88 62.38 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 120.816 0.341 . . . . 0.0 110.986 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.686 HD11 HD23 ' A' ' 523' ' ' LEU . 5.3 pt -78.79 -20.4 12.98 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.987 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -177.391 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.446 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.97 -12.48 38.08 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 121.678 -0.638 . . . . 0.0 112.537 176.919 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -118.83 15.78 13.47 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 122.527 0.331 . . . . 0.0 111.57 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.411 ' CE2' ' HB3' ' A' ' 531' ' ' ALA . 18.2 t80 -63.32 122.85 17.21 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.203 0.525 . . . . 0.0 112.005 -176.749 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -92.38 -26.3 18.11 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 116.484 2.031 . . . . 0.0 116.484 -177.378 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.411 ' HB3' ' CE2' ' A' ' 529' ' ' TYR . . . -62.7 -42.29 99.56 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.719 0.771 . . . . 0.0 110.559 -176.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -129.6 111.88 13.15 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -61.02 -38.05 84.73 Favored 'General case' 0 C--O 1.209 -1.038 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.731 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -57.15 -41.96 80.11 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 55.0 t -56.45 -43.28 77.4 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 6.9 ttp -66.47 -40.11 89.17 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 122.369 0.268 . . . . 0.0 110.759 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.24 -51.38 63.92 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 123.086 0.241 . . . . 0.0 110.368 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -70.16 -38.29 75.42 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 119.401 -0.92 . . . . 0.0 111.239 -177.616 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 539' ' ' ALA . . . . . 0.463 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -58.35 -40.71 82.92 Favored 'General case' 0 C--O 1.213 -0.868 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.465 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.446 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.51 -47.79 74.75 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.896 -1.047 . . . . 0.0 112.854 179.294 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -42.59 92.13 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.1 t -70.59 -49.72 50.2 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.085 0 C-N-CA 122.883 0.473 . . . . 0.0 111.61 -177.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -55.63 -44.97 77.62 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -178.064 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.3 m -66.71 -36.29 82.15 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 122.792 0.437 . . . . 0.0 110.889 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 9.3 mtt85 -58.84 -30.21 67.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.979 -0.451 . . . . 0.0 110.263 175.245 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.889 HD22 HG21 ' A' ' 508' ' ' VAL . 8.7 mt -76.63 -34.79 58.32 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -176.064 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -30.45 70.73 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.674 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 25.3 m -78.01 -10.21 59.49 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.428 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 79.5 mtt85 -110.8 -27.42 8.87 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -167.09 161.76 35.59 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 121.471 -0.395 . . . . 0.0 112.524 -178.379 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 9.5 m . . . . . 0 C--O 1.243 0.742 0 CA-C-O 117.702 -1.142 . . . . 0.0 112.864 -178.158 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -152.44 172.18 16.92 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 104.899 -2.26 . . . . 0.0 104.899 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 44.7 p -77.47 150.73 79.96 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -67.74 156.02 67.66 Favored 'Trans proline' 0 C--O 1.238 0.485 0 C-N-CA 118.205 -0.73 . . . . 0.0 112.787 178.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.2 m -67.26 162.16 23.29 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.245 -178.176 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.403 HG13 ' HB3' ' A' ' 506' ' ' LEU . 41.9 t -53.9 -46.75 64.59 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.389 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.429 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.6 pt-20 -62.09 -34.16 75.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.74 0.305 . . . . 0.0 111.566 -177.536 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.47 -41.9 79.49 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -73.17 -34.09 65.83 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.281 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.552 HD21 HG21 ' A' ' 519' ' ' VAL . 3.0 tt -58.95 -35.87 73.87 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.481 178.119 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -59.11 -40.18 84.56 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.906 -0.718 . . . . 0.0 109.647 178.629 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -67.29 -54.16 23.25 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.151 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -45.18 81.53 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.402 ' CG ' HG22 ' A' ' 519' ' ' VAL . 18.8 t-160 -58.89 -41.8 88.03 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 57.4 m -65.3 -39.31 92.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 119.406 -0.331 . . . . 0.0 111.649 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.506 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 58.5 mm-40 -64.49 -41.01 96.71 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.846 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.88 -47.22 75.78 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.214 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 177.219 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -65.79 -38.43 88.98 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -67.3 -34.01 76.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.866 0.365 . . . . 0.0 110.414 177.788 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.6 -17.45 64.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.0 mt -107.28 11.93 28.71 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -177.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -57.2 129.69 42.88 Favored 'General case' 0 CA--C 1.497 -1.081 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 16.1 m -71.32 -19.53 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.079 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.942 -178.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.84 -27.91 30.51 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 113.47 -1.695 . . . . 0.0 110.823 -179.562 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 77.4 p -163.76 79.19 1.57 Allowed Pre-proline 0 C--O 1.241 0.623 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.897 -176.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -73.49 147.84 41.68 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 115.493 -2.538 . . . . 0.0 112.782 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -137.28 100.09 4.16 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.751 0.786 . . . . 0.0 109.726 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.425 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.4 OUTLIER -60.5 -47.6 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.838 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -177.666 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -60.69 -30.15 69.75 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 -177.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.2 ttt180 -68.32 -41.59 80.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.448 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.38 -47.74 78.1 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.17 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 86.2 mt -57.37 -44.47 84.45 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -176.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -62.22 -38.49 89.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.772 0.796 . . . . 0.0 110.115 179.799 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.16 -48.32 62.58 Favored 'General case' 0 C--N 1.321 -0.631 0 O-C-N 121.693 -0.629 . . . . 0.0 110.078 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.448 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -56.18 -48.25 76.72 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.882 178.255 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -62.15 -35.71 79.61 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -175.404 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -72.78 -43.09 63.24 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 119.02 -1.072 . . . . 0.0 108.602 177.256 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.48 -35.82 70.67 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.237 0.541 . . . . 0.0 110.325 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.8 -18.81 68.85 Favored Glycine 0 C--O 1.242 0.602 0 N-CA-C 114.996 0.758 . . . . 0.0 114.996 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.8 t -109.27 -10.31 14.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 117.717 0.758 . . . . 0.0 110.293 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.403 ' HB3' HG13 ' A' ' 471' ' ' VAL . 1.4 mt -71.16 148.89 46.92 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.797 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.452 ' O ' HD13 ' A' ' 512' ' ' ILE . 32.6 tt0 -79.76 84.26 5.59 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 122.261 1.029 . . . . 0.0 109.264 178.476 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.921 HG21 HD22 ' A' ' 546' ' ' LEU . 35.5 m -98.54 47.73 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.163 0 CA-C-O 123.344 1.545 . . . . 0.0 108.188 -178.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 13.3 t -68.16 173.73 4.47 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.5 m -49.37 -33.76 14.41 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -173.09 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -53.91 -43.43 69.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 177.62 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.452 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.63 -41.77 14.31 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 CA-C-O 121.979 0.895 . . . . 0.0 109.431 179.371 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -39.47 81.3 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -175.406 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -67.55 -32.43 73.19 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.649 -178.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -89.11 -10.02 48.89 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.935 -0.306 . . . . 0.0 111.202 179.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -125.65 40.99 3.62 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.484 0.659 . . . . 0.0 112.163 -176.113 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 23.8 p -63.51 -24.45 67.82 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -62.15 -31.82 72.36 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.022 0.439 . . . . 0.0 112.024 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.552 HG21 HD21 ' A' ' 475' ' ' LEU . 23.6 t -71.11 -40.27 75.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 49.0 t -62.56 -36.83 76.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 178.193 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.82 -37.52 87.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.825 177.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.5 m -75.89 -38.38 57.87 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 118.531 0.605 . . . . 0.0 110.017 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.507 HD23 HD11 ' A' ' 526' ' ' ILE . 46.4 mt -57.78 -34.96 70.16 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.951 0.405 . . . . 0.0 111.417 178.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -65.33 -29.09 69.79 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 121.976 -0.453 . . . . 0.0 111.376 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -73.7 -44.32 56.82 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.733 0.301 . . . . 0.0 111.189 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.507 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.23 -22.14 13.46 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.877 0 N-CA-C 114.323 1.231 . . . . 0.0 114.323 -176.783 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -62.6 -16.03 54.4 Favored 'General case' 0 C--O 1.214 -0.793 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 176.555 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -118.65 19.28 13.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.044 0.538 . . . . 0.0 111.61 177.568 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -69.5 95.11 0.8 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -63.64 -27.59 69.34 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -178.122 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.5 -31.06 72.11 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -176.098 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -144.77 108.24 4.63 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.7 tptt -53.96 -46.27 71.57 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.043 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -55.92 -43.42 77.35 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.038 0.446 . . . . 0.0 111.992 -176.66 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.53 -44.76 85.54 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.491 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.575 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.3 ttp -64.72 -42.85 94.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 119.283 -0.389 . . . . 0.0 110.279 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -64.52 -48.36 75.41 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.828 179.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -68.88 -39.16 79.96 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 118.978 -1.089 . . . . 0.0 110.908 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.18 83.84 Favored 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 109.084 -0.709 . . . . 0.0 109.084 177.954 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.99 -48.21 71.99 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.868 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -42.12 93.64 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.9 t -70.52 -51.43 37.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.921 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.578 -178.553 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -54.07 -44.84 71.46 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 -177.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.7 m -66.17 -34.84 78.96 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 123.111 0.564 . . . . 0.0 111.638 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 26.1 mtt85 -62.45 -31.18 71.86 Favored 'General case' 0 C--O 1.217 -0.648 0 O-C-N 121.771 -0.581 . . . . 0.0 109.698 175.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.921 HD22 HG21 ' A' ' 508' ' ' VAL . 5.7 mt -75.03 -34.69 61.91 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -176.376 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -59.79 -33.43 71.71 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.392 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.3 m -81.6 -16.12 52.53 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -97.65 -15.14 20.56 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 122.21 -0.306 . . . . 0.0 111.758 179.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -158.21 -90.7 0.08 OUTLIER Glycine 0 C--O 1.227 -0.326 0 C-N-CA 121.26 -0.495 . . . . 0.0 112.972 -177.338 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--O 1.25 1.119 0 CA-C-O 115.694 -2.098 . . . . 0.0 105.602 -179.243 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.746 0 CA-C-O 118.528 -0.749 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 54.14 42.48 31.54 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 123.954 0.784 . . . . 0.0 109.663 -177.175 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 5.1 m -122.33 71.93 36.6 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.198 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.09 156.15 65.96 Favored 'Trans proline' 0 C--O 1.24 0.611 0 C-N-CA 118.2 -0.734 . . . . 0.0 113.048 -179.227 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.1 m -66.75 165.21 15.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.145 -178.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.46 HG13 ' HB3' ' A' ' 506' ' ' LEU . 53.3 t -56.08 -47.23 80.74 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.771 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -64.08 -34.24 77.58 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -67.27 -43.64 81.33 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.991 0.901 . . . . 0.0 108.783 177.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 24.8 mttt -69.04 -34.27 74.94 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.0 -178.144 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.412 HD21 HG21 ' A' ' 519' ' ' VAL . 1.5 tm? -58.63 -36.98 74.93 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.355 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -54.92 -40.78 70.23 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.04 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 62.6 tttt -68.97 -55.06 12.06 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 176.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.23 -46.87 79.37 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -176.357 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -60.88 -40.61 93.65 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.0 m -63.98 -41.89 97.39 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.549 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.46 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.5 mm-40 -63.12 -42.89 99.61 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 118.004 0.365 . . . . 0.0 110.872 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.63 -47.49 72.49 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -67.2 -37.32 83.47 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -177.079 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -67.15 -33.73 76.05 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.569 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.0 -17.36 64.89 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 27.9 mt -107.06 12.08 28.94 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -56.05 132.42 50.05 Favored 'General case' 0 C--O 1.21 -1.006 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 177.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.84 -41.1 91.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 175.645 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -65.55 -28.76 69.39 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.056 -1.884 . . . . 0.0 113.782 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 19.0 m -159.93 72.85 3.15 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -176.189 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.41 141.49 28.58 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 114.18 -3.413 . . . . 0.0 112.27 179.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -137.27 100.15 4.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.579 0.704 . . . . 0.0 110.214 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.416 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.3 OUTLIER -58.16 -46.55 88.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.433 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -57.87 -31.93 67.19 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -178.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -70.82 -39.88 72.79 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 -176.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.42 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.42 -48.61 72.21 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.921 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.6 mt -56.83 -42.94 80.52 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -176.252 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -65.0 -38.44 90.97 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.424 0.63 . . . . 0.0 111.836 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.46 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -68.42 -47.53 67.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.579 0.704 . . . . 0.0 109.582 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.42 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -55.07 -48.11 73.95 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.875 177.743 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -63.96 -34.12 77.26 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -175.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -69.56 -46.88 65.37 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 176.295 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.408 HD21 HD23 ' A' ' 475' ' ' LEU . 1.1 tm? -58.44 -33.6 69.89 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.191 0.52 . . . . 0.0 110.901 -178.754 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.81 -18.29 63.95 Favored Glycine 0 C--O 1.235 0.191 0 CA-C-O 119.451 -0.638 . . . . 0.0 114.359 179.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.1 t -111.36 -12.44 14.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.911 0.856 . . . . 0.0 110.466 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.46 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.9 mt -68.87 146.48 52.79 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.982 -0.448 . . . . 0.0 110.228 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.416 ' O ' HD13 ' A' ' 512' ' ' ILE . 36.5 tt0 -79.22 84.4 5.18 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 122.762 1.267 . . . . 0.0 110.21 178.692 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.898 HG21 HD22 ' A' ' 546' ' ' LEU . 27.0 m -96.19 45.8 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 CA-C-O 122.8 1.286 . . . . 0.0 109.11 -178.547 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.1 t -66.47 171.31 5.08 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -177.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.5 m -49.26 -30.19 6.9 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -174.51 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -55.43 -45.71 76.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.522 0.201 . . . . 0.0 111.475 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -88.75 -40.3 13.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.283 0.563 . . . . 0.0 109.819 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.499 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.91 -34.93 75.42 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -174.941 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -64.62 -31.68 73.01 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.786 0.803 . . . . 0.0 111.817 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -95.34 -3.04 47.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.899 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -126.19 38.91 4.05 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.163 0.506 . . . . 0.0 110.526 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.5 p -63.81 -29.27 70.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -63.58 -26.74 68.83 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.586 0.708 . . . . 0.0 111.83 177.888 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.412 HG21 HD21 ' A' ' 475' ' ' LEU . 38.4 t -71.66 -42.85 71.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.2 t -62.82 -35.96 73.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.11 85.69 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.06 176.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 98.0 m -77.91 -38.54 45.44 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 118.958 0.799 . . . . 0.0 110.011 -179.503 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.531 HD23 HD11 ' A' ' 526' ' ' ILE . 45.0 mt -57.52 -35.13 69.87 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.01 0.433 . . . . 0.0 111.393 178.776 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -64.95 -29.03 69.93 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.948 -0.47 . . . . 0.0 111.538 175.567 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -73.43 -45.14 56.26 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.768 0.318 . . . . 0.0 111.259 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.531 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -77.06 -23.4 14.82 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.923 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -176.405 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.439 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.2 OUTLIER -60.2 -19.32 53.69 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 176.413 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -118.64 19.32 13.27 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.093 0.557 . . . . 0.0 111.897 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -63.59 109.68 1.74 Allowed 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -176.501 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -72.51 -29.27 63.46 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -177.691 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.65 -24.84 64.58 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -174.333 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -150.79 119.25 6.44 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.774 -0.371 . . . . 0.0 110.422 178.26 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -61.38 -45.94 92.27 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.121 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -56.89 -40.36 76.1 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.185 0.517 . . . . 0.0 111.515 -175.396 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.7 t -56.05 -45.09 80.34 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -64.55 -43.93 92.37 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 119.12 -0.467 . . . . 0.0 110.08 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.54 -47.59 78.21 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.305 -0.558 . . . . 0.0 111.99 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -68.72 -40.28 80.0 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 119.627 -0.829 . . . . 0.0 110.934 -178.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.94 86.89 Favored 'General case' 0 C--O 1.213 -0.852 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.439 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.12 -48.79 74.71 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.354 -0.839 . . . . 0.0 113.15 179.087 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -43.96 95.0 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 59.0 t -68.69 -50.13 58.14 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.676 -178.253 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -54.68 -45.03 73.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.657 0.265 . . . . 0.0 110.374 -177.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 10.3 m -67.15 -34.13 76.92 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.755 0.312 . . . . 0.0 111.273 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -60.76 -28.94 69.09 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.613 -0.68 . . . . 0.0 109.732 175.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.898 HD22 HG21 ' A' ' 508' ' ' VAL . 9.2 mt -76.39 -34.24 58.87 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -174.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -29.09 70.48 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.418 178.478 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.6 m -79.63 -8.6 59.31 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.456 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 74.0 mtt85 -113.65 -25.63 8.62 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -161.14 162.41 33.67 Favored Glycine 0 N--CA 1.453 -0.221 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -178.525 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 11.2 m . . . . . 0 C--O 1.243 0.75 0 CA-C-O 118.261 -0.876 . . . . 0.0 113.134 -177.06 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 119.0 -0.524 . . . . 0.0 109.624 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -67.36 -33.19 74.72 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 117.841 0.291 . . . . 0.0 111.518 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 15.4 m 46.73 58.98 16.63 Favored Pre-proline 0 N--CA 1.474 0.756 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -70.74 161.12 47.16 Favored 'Trans proline' 0 C--N 1.349 0.592 0 N-CA-C 114.986 1.11 . . . . 0.0 114.986 -177.441 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 8.9 m -68.7 163.86 22.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.342 -0.845 . . . . 0.0 113.091 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 35.6 t -53.86 -47.13 64.14 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.132 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.1 pt-20 -64.7 -34.31 78.01 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 120.718 0.294 . . . . 0.0 111.41 -176.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -67.25 -41.33 85.78 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -73.27 -33.61 65.35 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.891 -176.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.488 HD21 HG21 ' A' ' 519' ' ' VAL . 5.0 tt -56.74 -35.58 68.77 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.005 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -55.5 -41.02 72.49 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.253 0.479 . . . . 0.0 110.634 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -66.38 -54.68 21.59 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 177.376 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -47.23 85.18 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -176.505 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.477 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.6 t-160 -58.98 -43.08 91.34 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.706 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 62.2 m -64.13 -39.03 93.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 117.752 0.251 . . . . 0.0 111.619 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.401 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.3 mm-40 -64.23 -37.26 86.84 Favored 'General case' 0 CA--C 1.501 -0.935 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.595 179.001 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.14 -44.0 86.62 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.993 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 178.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.3 mmtt -62.94 -43.08 99.76 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.606 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -67.59 -34.12 76.38 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.73 0.3 . . . . 0.0 111.02 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.84 -15.29 63.52 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 29.7 mt -111.46 12.17 21.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.526 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -58.04 141.4 50.05 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 121.96 0.886 . . . . 0.0 109.562 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 70.7 t -65.42 -36.29 77.33 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 CA-C-N 113.86 -1.518 . . . . 0.0 107.808 174.024 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -74.92 -29.47 60.97 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.127 -1.851 . . . . 0.0 112.238 -173.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 10.2 t -165.98 79.54 1.14 Allowed Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.589 -175.228 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -73.07 142.5 34.52 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 115.082 -2.812 . . . . 0.0 112.163 176.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.4 t0 -137.13 100.34 4.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.451 0.643 . . . . 0.0 110.383 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.4 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.8 OUTLIER -55.5 -46.01 78.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -178.894 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -32.61 68.91 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-O 121.974 0.892 . . . . 0.0 109.933 -176.798 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -70.41 -40.55 73.8 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.269 -1.332 . . . . 0.0 108.633 -176.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.415 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.59 -50.31 65.57 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 175.305 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.7 mt -56.82 -42.83 80.3 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -65.52 -37.89 88.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.585 0.707 . . . . 0.0 111.655 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.77 -46.88 64.83 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.622 0.725 . . . . 0.0 109.694 178.172 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.415 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.92 -49.34 71.53 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.873 177.677 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -59.32 -36.58 75.91 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.8 -44.59 61.32 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.4 -34.79 72.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.059 0.457 . . . . 0.0 110.459 -178.36 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.46 -16.48 65.27 Favored Glycine 0 C--O 1.24 0.491 0 N-CA-C 115.359 0.904 . . . . 0.0 115.359 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.4 t -113.01 -12.19 13.26 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.413 0.607 . . . . 0.0 110.633 -179.452 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -67.64 149.19 50.38 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.428 ' O ' HD13 ' A' ' 512' ' ' ILE . 37.1 tt0 -77.28 84.51 3.73 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-O 122.537 1.16 . . . . 0.0 108.979 177.701 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.87 HG21 HD22 ' A' ' 546' ' ' LEU . 26.9 m -98.73 47.59 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 CA-C-O 122.96 1.362 . . . . 0.0 108.194 -178.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.0 t -66.21 173.43 3.16 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 -179.246 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.8 m -49.33 -33.65 13.87 Favored 'General case' 0 C--O 1.211 -0.949 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -174.123 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -55.35 -45.44 76.47 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.202 -0.311 . . . . 0.0 111.771 177.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.428 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.1 mp -83.76 -42.52 17.4 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.597 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.424 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.92 -37.32 79.11 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -175.746 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -66.78 -32.89 74.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.477 0.18 . . . . 0.0 111.401 -179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -88.87 -6.44 57.32 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.843 179.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -129.89 44.35 2.98 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -178.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 32.3 p -64.88 -24.76 67.63 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.84 -33.26 75.59 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 122.399 1.095 . . . . 0.0 112.317 178.475 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.488 HG21 HD21 ' A' ' 475' ' ' LEU . 91.5 t -67.69 -43.18 86.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 520' ' ' VAL . . . . . 0.412 HG21 HD13 ' A' ' 513' ' ' LEU . 40.4 t -64.28 -37.45 79.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.91 -34.5 78.1 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.642 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 87.4 m -76.59 -39.64 51.98 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.58 HD23 HD11 ' A' ' 526' ' ' ILE . 51.9 mt -58.62 -34.79 71.55 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.1 0.476 . . . . 0.0 110.926 179.025 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -64.65 -29.18 70.18 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.912 -0.493 . . . . 0.0 111.32 175.086 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -73.05 -44.75 60.27 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 122.283 -0.261 . . . . 0.0 111.654 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.58 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.43 -20.57 13.27 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.905 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 -176.362 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.4 OUTLIER -62.19 -17.41 58.04 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 177.165 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -118.72 19.31 13.21 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.174 0.59 . . . . 0.0 112.128 176.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.434 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 13.2 t80 -63.8 117.68 7.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.06 0.457 . . . . 0.0 112.211 -177.482 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -75.97 -31.47 59.03 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.434 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -64.11 -41.73 97.14 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -173.303 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -133.21 118.27 18.42 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -178.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -58.8 -45.7 89.27 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.362 178.638 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -56.07 -41.75 75.59 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -176.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 68.6 t -56.57 -44.94 81.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.658 0 O-C-N 121.87 -0.519 . . . . 0.0 109.813 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.7 ttp -64.07 -43.89 94.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 119.167 -0.444 . . . . 0.0 109.846 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.89 -47.39 77.98 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.326 -0.55 . . . . 0.0 112.085 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -70.11 -37.96 75.5 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 119.089 -1.045 . . . . 0.0 111.253 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.54 -40.65 87.93 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.153 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.41 -49.23 72.35 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.543 179.038 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.36 -43.23 88.3 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 55.2 t -70.32 -49.98 49.87 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.041 0 C-N-CA 122.924 0.49 . . . . 0.0 111.318 -177.758 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -55.44 -45.82 76.81 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -178.144 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 17.6 m -66.18 -35.18 79.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.515 0.674 . . . . 0.0 111.029 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 13.1 mtt85 -60.82 -30.32 70.01 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.993 -0.442 . . . . 0.0 109.952 174.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.87 HD22 HG21 ' A' ' 508' ' ' VAL . 8.3 mt -76.55 -34.48 58.5 Favored 'General case' 0 C--O 1.208 -1.119 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 -176.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -28.19 69.22 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.587 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 25.2 m -78.24 -8.58 58.52 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.67 -1.15 . . . . 0.0 111.946 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -117.23 -21.68 8.66 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -169.31 163.53 37.17 Favored Glycine 0 CA--C 1.519 0.303 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 10.9 m . . . . . 0 C--O 1.248 1.015 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -176.301 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 55.38 36.89 28.04 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.912 0.758 . . . . 0.0 111.249 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 15.0 m -133.45 79.17 61.03 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.207 -178.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.32 161.69 44.85 Favored 'Trans proline' 0 C--O 1.237 0.469 0 O-C-N 122.089 0.521 . . . . 0.0 112.721 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 7.3 m -64.57 160.46 19.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.013 -0.539 . . . . 0.0 112.399 -177.605 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.496 HG23 ' HB3' ' A' ' 506' ' ' LEU . 0.1 OUTLIER -53.06 -54.21 18.23 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.137 0 CA-C-O 121.967 0.889 . . . . 0.0 112.134 -179.627 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -54.24 -34.24 60.24 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 113.744 -1.571 . . . . 0.0 113.423 178.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -69.85 -43.8 71.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 122.531 1.157 . . . . 0.0 108.167 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -70.06 -32.77 71.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.564 -177.245 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.722 HD21 HG21 ' A' ' 519' ' ' VAL . 2.5 tt -56.99 -35.66 69.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.447 178.191 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -58.5 -40.75 83.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.523 0.601 . . . . 0.0 109.92 178.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -66.85 -54.89 17.86 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 110.334 -0.247 . . . . 0.0 110.334 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -43.31 90.98 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.569 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.481 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.5 t-160 -57.31 -44.05 83.78 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.9 m -63.95 -38.5 91.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.485 0.18 . . . . 0.0 111.485 -179.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -63.3 -38.65 91.98 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.28 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.9 mt -58.22 -43.95 86.86 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -62.85 -44.74 95.32 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -178.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -66.36 -31.8 72.8 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.023 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.2 -18.39 65.23 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.897 0.702 . . . . 0.0 112.897 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 486' ' ' LEU . . . . . 0.41 HD11 ' CG2' ' A' ' 526' ' ' ILE . 20.9 mt -106.84 12.14 29.29 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -177.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -54.72 130.15 39.52 Favored 'General case' 0 C--O 1.208 -1.119 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 178.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 55.8 t -63.5 -42.2 95.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 122.056 0.931 . . . . 0.0 109.471 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -67.6 -30.86 70.56 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 113.979 -1.464 . . . . 0.0 112.975 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 13.8 t -160.08 77.55 2.73 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.002 -175.416 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.61 149.23 34.01 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 117.123 -1.451 . . . . 0.0 112.383 179.046 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -137.21 97.77 3.57 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.857 0.836 . . . . 0.0 110.078 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.7 OUTLIER -58.22 -46.36 88.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -179.212 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -59.74 -31.38 69.58 Favored 'General case' 0 CA--C 1.504 -0.811 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -177.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -69.08 -41.6 77.32 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.53 -47.89 77.12 Favored 'General case' 0 C--O 1.21 -1.021 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 175.912 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 84.6 mt -57.68 -44.06 85.52 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 118.045 0.384 . . . . 0.0 111.346 -176.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -63.07 -40.88 99.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.735 0.779 . . . . 0.0 110.901 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.14 -46.65 73.44 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.762 0.791 . . . . 0.0 109.529 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.401 HD23 ' HB3' ' A' ' 538' ' ' LYS . 0.0 OUTLIER -56.11 -51.16 68.91 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.337 178.339 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -61.44 -35.66 78.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -175.142 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.26 -43.25 64.6 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 118.775 -1.17 . . . . 0.0 108.473 177.585 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -33.31 67.6 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.359 0.599 . . . . 0.0 109.895 178.385 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.62 -17.68 69.21 Favored Glycine 0 C--O 1.238 0.379 0 N-CA-C 114.833 0.693 . . . . 0.0 114.833 179.502 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.3 t -110.5 -14.83 14.03 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 117.714 0.757 . . . . 0.0 110.402 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.496 ' HB3' HG23 ' A' ' 471' ' ' VAL . 2.4 mt -66.51 149.28 50.68 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.008 -0.433 . . . . 0.0 110.211 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.415 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.1 tt0 -78.76 84.4 4.83 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-O 122.324 1.059 . . . . 0.0 111.916 -178.783 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.504 HG21 HD22 ' A' ' 546' ' ' LEU . 17.5 m -106.93 76.9 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 CA-C-O 126.897 3.237 . . . . 0.0 106.514 176.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.3 t -88.46 171.59 9.99 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 110.235 -3.166 . . . . 0.0 103.677 172.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.26 -34.61 15.6 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.49 -41.51 73.13 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.415 HD13 ' O ' ' A' ' 507' ' ' GLN . 3.8 mp -88.74 -39.65 12.72 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.822 0 CA-C-O 122.483 1.135 . . . . 0.0 108.912 -178.644 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 31.1 mt -60.78 -39.65 89.65 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.139 -174.214 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -63.44 -34.82 78.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -89.95 -8.06 52.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.24 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -125.92 37.83 4.27 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.428 0.632 . . . . 0.0 110.711 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 3.6 p -61.1 -28.11 68.85 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -178.084 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.57 -30.46 71.57 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.426 0.631 . . . . 0.0 112.136 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.722 HG21 HD21 ' A' ' 475' ' ' LEU . 34.0 t -74.24 -42.94 50.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.38 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.7 t -61.94 -37.75 79.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.86 -37.76 88.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.734 177.154 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 95.6 m -71.23 -39.31 71.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.679 HD23 HD11 ' A' ' 526' ' ' ILE . 70.0 mt -59.67 -35.75 75.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.199 0.523 . . . . 0.0 110.362 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -65.2 -29.09 69.87 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.947 -0.471 . . . . 0.0 111.254 175.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -72.18 -45.62 59.65 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 122.098 -0.376 . . . . 0.0 111.349 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.679 HD11 HD23 ' A' ' 523' ' ' LEU . 17.1 pt -78.79 -18.1 13.3 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.864 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -176.672 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.468 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.79 -15.93 59.94 Favored 'General case' 0 C--O 1.212 -0.899 0 O-C-N 121.965 -0.459 . . . . 0.0 111.503 176.287 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -118.72 17.94 13.47 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 122.774 0.429 . . . . 0.0 111.241 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.41 ' CE2' ' HB3' ' A' ' 531' ' ' ALA . 14.7 t80 -63.02 123.65 19.11 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.667 0.387 . . . . 0.0 110.207 -178.346 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -92.4 -21.92 19.94 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 -175.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.41 ' HB3' ' CE2' ' A' ' 529' ' ' TYR . . . -65.89 -41.61 91.31 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.265 0.555 . . . . 0.0 110.589 -177.58 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -130.26 115.55 17.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.025 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.6 tptt -55.76 -47.95 76.13 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.222 177.785 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -54.99 -42.81 72.95 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -175.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.7 t -56.68 -45.08 82.57 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 O-C-N 122.016 -0.428 . . . . 0.0 109.887 177.164 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.4 ttp -65.04 -43.79 91.19 Favored 'General case' 0 CA--C 1.51 -0.59 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.56 -48.6 76.78 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 538' ' ' LYS . . . . . 0.401 ' HB3' HD23 ' A' ' 500' ' ' LEU . 44.0 tptt -71.0 -38.36 72.66 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.282 -178.085 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.52 -39.96 85.58 Favored 'General case' 0 CA--C 1.501 -0.926 0 CA-C-O 121.625 0.726 . . . . 0.0 109.044 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.468 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.89 -49.04 76.4 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.535 -1.211 . . . . 0.0 113.052 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.81 -41.35 91.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 51.2 t -70.45 -51.99 33.13 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.021 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.676 -177.562 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -54.59 -45.05 73.51 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.633 0.254 . . . . 0.0 110.317 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 20.5 m -65.93 -36.03 82.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.886 0.374 . . . . 0.0 111.248 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -59.37 -30.74 68.62 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.038 -0.413 . . . . 0.0 110.26 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.504 HD22 HG21 ' A' ' 508' ' ' VAL . 6.3 mt -76.63 -32.81 58.26 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 -176.628 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.71 -30.22 71.35 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.67 179.46 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 36.2 m -75.13 -16.47 60.53 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.706 176.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -100.79 -23.72 14.54 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 178.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -177.56 173.64 46.29 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 121.251 -0.499 . . . . 0.0 112.773 -178.012 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 C--O 1.251 1.135 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -176.933 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 118.95 -0.547 . . . . 0.0 109.574 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -133.78 33.67 3.45 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 14.8 m -76.75 139.94 67.04 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.91 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.84 150.63 73.82 Favored 'Trans proline' 0 C--O 1.24 0.62 0 C-N-CA 117.289 -1.34 . . . . 0.0 113.129 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.3 m -69.25 163.2 25.54 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.798 -178.874 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.435 HG13 ' HB3' ' A' ' 506' ' ' LEU . 44.0 t -54.8 -46.9 75.04 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 179.478 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.412 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.9 OUTLIER -62.24 -34.35 76.34 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -178.454 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -67.91 -41.2 83.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.579 1.181 . . . . 0.0 108.184 179.698 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 474' ' ' LYS . . . . . 0.405 ' O ' HD22 ' A' ' 478' ' ' LEU . 58.2 mtpt -72.9 -35.31 67.06 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.569 -177.876 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.5 HD21 HG21 ' A' ' 519' ' ' VAL . 3.8 tt -57.92 -36.66 72.8 Favored 'General case' 0 C--O 1.211 -0.933 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.361 178.464 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -57.32 -42.42 81.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.835 0.743 . . . . 0.0 110.124 177.909 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -67.44 -54.33 21.23 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.645 178.118 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 478' ' ' LEU . . . . . 0.405 HD22 ' O ' ' A' ' 474' ' ' LYS . 0.1 OUTLIER -58.27 -44.85 88.62 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -178.465 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.426 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.6 t-160 -57.79 -44.5 86.31 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -179.89 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.2 m -62.84 -39.3 93.94 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.623 0.231 . . . . 0.0 111.623 -179.03 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.456 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 14.6 mm-40 -63.98 -37.53 87.77 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.396 178.507 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.4 mt -58.99 -43.53 89.08 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 178.876 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -64.01 -44.06 93.76 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 122.082 -0.386 . . . . 0.0 112.003 -178.875 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -65.83 -32.8 74.52 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.75 -178.876 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.89 -16.67 64.19 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 179.224 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 35.2 mt -110.51 12.21 22.91 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -177.224 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 50.0 mttt -55.26 132.65 48.32 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.255 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.9 t -64.17 -41.71 93.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 122.343 1.068 . . . . 0.0 108.484 176.808 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -68.14 -29.75 68.71 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 113.574 -1.648 . . . . 0.0 113.281 -178.417 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 10.8 t -160.69 75.99 2.65 Favored Pre-proline 0 N--CA 1.469 0.513 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -175.662 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.36 145.87 30.75 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 117.203 -1.398 . . . . 0.0 113.206 178.915 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -137.32 100.66 4.3 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.286 0.565 . . . . 0.0 111.092 178.826 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.441 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.5 OUTLIER -56.66 -45.36 82.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -179.341 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 10.9 pttt -59.33 -32.53 70.17 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 121.89 0.852 . . . . 0.0 109.605 -176.919 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -70.39 -40.8 73.73 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.417 -1.265 . . . . 0.0 108.816 -176.473 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.81 -48.5 71.5 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 175.887 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.8 mt -56.93 -43.39 81.44 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -176.724 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -65.42 -37.9 88.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.488 0.661 . . . . 0.0 111.745 179.608 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.456 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.33 -46.67 66.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.721 0.772 . . . . 0.0 109.682 178.363 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -49.39 72.75 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.396 178.938 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -61.46 -34.66 75.83 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -175.238 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -45.71 60.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 176.731 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.93 -33.51 68.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.465 0.65 . . . . 0.0 109.868 -178.691 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.93 -17.87 68.05 Favored Glycine 0 C--O 1.236 0.251 0 CA-C-O 119.206 -0.775 . . . . 0.0 114.852 179.423 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.7 t -112.53 -6.23 13.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.345 1.073 . . . . 0.0 110.894 -179.733 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.435 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.0 mt -72.49 150.16 43.5 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.05 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -78.84 84.46 4.89 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-O 122.671 1.224 . . . . 0.0 109.213 178.145 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.897 HG21 HD22 ' A' ' 546' ' ' LEU . 27.1 m -98.63 50.72 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-O 123.536 1.636 . . . . 0.0 109.115 -177.379 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 3.7 t -64.51 167.83 6.62 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 -179.514 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.7 m -49.25 -32.16 10.16 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -176.185 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -55.38 -44.7 76.31 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 178.28 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.0 mp -85.97 -43.46 16.46 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-O 121.961 0.886 . . . . 0.0 108.887 179.86 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.57 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.13 -39.91 79.91 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -175.182 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -72.7 -28.51 62.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.346 -176.767 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -88.99 -8.25 54.45 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.862 176.709 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -125.1 40.97 3.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.631 0.729 . . . . 0.0 111.735 -179.066 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 10.7 p -62.75 -24.48 67.72 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -179.103 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.62 -30.86 71.92 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.45 0.643 . . . . 0.0 112.037 177.954 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.5 HG21 HD21 ' A' ' 475' ' ' LEU . 22.6 t -71.87 -41.34 69.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.89 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 520' ' ' VAL . . . . . 0.418 HG21 HD13 ' A' ' 513' ' ' LEU . 29.9 t -63.22 -37.98 80.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.681 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.93 -32.59 74.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.653 177.737 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.4 m -79.49 -40.22 30.24 Favored 'General case' 0 C--O 1.217 -0.632 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.512 HD23 HD11 ' A' ' 526' ' ' ILE . 38.7 mt -57.61 -35.41 70.42 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.114 0.483 . . . . 0.0 111.039 178.57 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -63.97 -29.05 70.24 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.07 -0.394 . . . . 0.0 111.533 175.175 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -74.13 -45.42 48.98 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.272 -0.268 . . . . 0.0 111.547 178.655 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.512 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -77.53 -21.23 14.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.932 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 -176.427 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -61.56 -18.87 61.12 Favored 'General case' 0 C--O 1.211 -0.959 0 O-C-N 121.961 -0.462 . . . . 0.0 111.658 176.056 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.75 19.44 13.15 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.154 0.582 . . . . 0.0 111.965 177.15 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.435 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 10.1 t80 -59.97 123.32 16.72 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.136 0.493 . . . . 0.0 111.629 -177.805 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -81.79 -28.46 33.18 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -176.744 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.435 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -69.17 -38.81 78.9 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -174.721 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -135.05 121.38 20.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.768 0.318 . . . . 0.0 110.765 -177.937 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.7 tptt -64.17 -40.32 95.87 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 178.221 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -46.97 73.88 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 123.341 0.656 . . . . 0.0 111.467 -176.525 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.0 t -58.73 -44.75 90.74 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.904 178.331 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -62.11 -44.2 97.16 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.97 -47.45 77.53 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.419 -0.512 . . . . 0.0 112.229 179.814 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -70.18 -38.21 75.34 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 118.408 -1.317 . . . . 0.0 111.285 -178.75 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.4 -39.73 84.34 Favored 'General case' 0 C--O 1.213 -0.832 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.365 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.421 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.91 -48.93 72.4 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.813 -1.085 . . . . 0.0 113.036 178.756 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -41.62 89.55 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.84 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.9 t -70.52 -50.33 46.08 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.013 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.937 -178.276 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -55.49 -44.74 76.81 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 -178.211 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.1 m -66.63 -35.57 80.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.263 0.554 . . . . 0.0 111.131 179.184 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 15.5 mtt85 -61.2 -29.43 69.81 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.879 -0.513 . . . . 0.0 109.99 175.217 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.897 HD22 HG21 ' A' ' 508' ' ' VAL . 8.8 mt -76.6 -36.03 57.76 Favored 'General case' 0 C--O 1.205 -1.268 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -177.555 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -30.1 70.24 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.588 178.931 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.4 m -75.7 -8.55 57.11 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.108 178.483 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 67.3 mtt85 -118.28 -23.28 7.34 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -179.945 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . 172.83 147.82 6.01 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 115.183 0.833 . . . . 0.0 115.183 178.974 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 551' ' ' SER . . . . . 0.432 ' HB2' HD12 ' A' ' 513' ' ' LEU . 3.7 m . . . . . 0 C--O 1.254 1.326 0 N-CA-C 115.64 1.719 . . . . 0.0 115.64 177.476 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -70.7 164.48 24.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 176.79 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.0 m -145.44 152.24 49.27 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 178.048 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -67.57 151.49 79.49 Favored 'Trans proline' 0 C--O 1.244 0.781 0 C-N-CA 118.204 -0.73 . . . . 0.0 113.787 -179.04 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.4 m -69.8 168.82 14.29 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.86 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.441 HG13 HD23 ' A' ' 506' ' ' LEU . 45.0 t -56.09 -47.93 79.74 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.929 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -179.749 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.4 OUTLIER -64.94 -34.26 78.0 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -178.57 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -66.49 -43.59 84.98 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.024 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 19.7 mttt -69.37 -33.75 73.53 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.368 -178.02 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -56.71 -38.88 72.93 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.607 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.98 -40.22 69.84 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.992 -178.862 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -67.02 -55.06 16.0 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 176.89 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -46.14 90.63 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -176.712 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -61.45 -39.5 91.05 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.644 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 65.2 m -65.11 -41.17 95.17 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.556 179.164 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.13 -42.64 99.56 Favored 'General case' 0 CA--C 1.501 -0.934 0 C-N-CA 120.976 -0.289 . . . . 0.0 111.19 178.388 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -54.65 -46.64 73.16 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.269 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.683 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 43.6 mtpt -67.81 -38.85 83.81 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -177.425 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -67.32 -32.92 74.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.895 0.379 . . . . 0.0 110.198 178.099 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.0 -19.68 66.12 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 178.955 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 25.4 mt -105.22 12.16 32.21 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.386 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 29.4 mtpt -55.66 130.38 42.92 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.564 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 44.9 t -63.6 -40.51 89.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 122.395 1.093 . . . . 0.0 108.931 177.992 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -30.44 71.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.568 -1.651 . . . . 0.0 113.016 -178.24 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 2.7 p -163.08 79.66 1.68 Allowed Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.343 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.04 146.28 51.9 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 116.938 -1.575 . . . . 0.0 112.265 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -137.22 92.65 2.73 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.513 0.673 . . . . 0.0 109.921 -175.714 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.418 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.9 OUTLIER -58.9 -45.0 92.06 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.798 0 N-CA-C 113.391 0.885 . . . . 0.0 113.391 -177.229 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -57.12 -31.9 65.78 Favored 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -178.885 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -71.03 -41.47 70.81 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.675 -177.87 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.474 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -63.92 -48.61 75.9 Favored 'General case' 0 C--O 1.211 -0.942 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 176.7 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 81.2 mt -57.99 -44.19 87.01 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 117.863 0.301 . . . . 0.0 111.619 -176.935 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.16 -39.07 91.4 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.622 0.725 . . . . 0.0 110.735 178.88 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.82 -49.33 62.83 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.357 0.598 . . . . 0.0 109.796 178.816 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.474 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.06 -45.43 83.24 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.52 178.282 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -65.35 -33.31 75.66 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 121.243 -0.91 . . . . 0.0 112.504 -176.848 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -67.8 -49.37 62.71 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 105.307 -2.108 . . . . 0.0 105.307 175.395 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -30.63 33.53 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.54 0.686 . . . . 0.0 111.119 -177.64 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -62.97 -28.36 71.88 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 114.894 0.718 . . . . 0.0 114.894 178.163 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 8.0 t -100.86 -26.36 13.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 117.745 0.773 . . . . 0.0 110.808 -179.342 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.441 HD23 HG13 ' A' ' 471' ' ' VAL . 3.0 mp -55.46 136.01 50.04 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 176.362 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -78.81 84.37 4.87 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-O 122.975 1.369 . . . . 0.0 110.416 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.919 HG21 HD22 ' A' ' 546' ' ' LEU . 27.4 m -95.7 48.5 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.325 0 CA-C-O 122.963 1.363 . . . . 0.0 108.734 -178.988 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 8.9 t -66.92 171.64 5.21 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 -178.219 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.23 -30.74 7.52 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -174.369 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -55.48 -46.55 76.87 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.391 -0.193 . . . . 0.0 111.519 177.052 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -87.12 -41.05 14.42 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 CA-C-O 121.511 0.672 . . . . 0.0 109.695 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.507 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.7 -36.18 76.0 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -174.894 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -65.4 -32.27 73.81 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.755 0.788 . . . . 0.0 111.722 -178.679 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -95.76 -0.33 51.49 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.801 -179.229 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -133.01 42.59 3.04 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.568 0.699 . . . . 0.0 111.613 179.175 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.2 p -64.14 -27.21 68.93 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -179.122 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -65.04 -24.43 67.48 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.654 0.74 . . . . 0.0 111.938 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 55.4 t -70.55 -43.53 77.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 179.173 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 28.8 t -64.21 -36.17 76.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.238 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.26 -38.27 88.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.813 177.325 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.4 m -76.08 -38.6 56.84 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 118.874 0.761 . . . . 0.0 109.861 -179.551 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.587 HD23 HD11 ' A' ' 526' ' ' ILE . 49.5 mt -58.15 -35.19 71.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.02 0.438 . . . . 0.0 111.226 178.639 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -64.46 -29.18 70.23 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.993 -0.442 . . . . 0.0 111.465 175.129 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -73.04 -46.31 52.54 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 117.767 0.258 . . . . 0.0 111.423 178.845 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.587 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -77.21 -20.52 14.3 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -176.106 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.419 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -62.44 -15.82 51.63 Favored 'General case' 0 C--O 1.212 -0.885 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 177.259 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 11.6 ptp85 -118.69 19.34 13.23 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.031 0.533 . . . . 0.0 111.458 175.891 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -64.07 105.69 0.92 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -175.72 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -70.09 -30.14 67.29 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -176.703 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.74 -27.5 66.85 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -174.637 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -147.69 113.74 5.82 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.096 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 41.8 tptt -56.71 -45.46 81.87 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.531 -178.294 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -56.48 -40.68 75.32 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.987 0.422 . . . . 0.0 112.003 -175.836 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -56.84 -45.1 83.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 177.384 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -64.84 -43.41 93.14 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 119.192 -0.432 . . . . 0.0 110.241 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.48 -48.17 76.2 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.409 -0.517 . . . . 0.0 112.005 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 31.4 tptt -68.62 -39.48 80.78 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.071 -178.841 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.63 -40.82 84.46 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-O 121.306 0.574 . . . . 0.0 109.518 177.827 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.419 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.5 -48.27 75.78 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.247 -0.888 . . . . 0.0 113.296 179.433 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -42.24 93.67 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.1 t -70.65 -50.09 47.09 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.8 -178.579 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -54.79 -45.46 74.33 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.733 0.301 . . . . 0.0 110.193 -177.351 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.6 m -66.82 -33.97 76.77 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.397 0.617 . . . . 0.0 111.312 179.916 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 13.1 mtt85 -61.35 -29.81 70.13 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 121.796 -0.565 . . . . 0.0 109.96 174.885 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.919 HD22 HG21 ' A' ' 508' ' ' VAL . 9.0 mt -76.52 -34.01 58.58 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -175.208 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -27.87 69.63 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.961 178.08 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.7 m -81.44 -8.66 59.76 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.607 -1.179 . . . . 0.0 112.075 177.505 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 69.4 mtt85 -114.15 -22.74 9.85 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 179.536 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -165.82 164.53 37.46 Favored Glycine 0 N--CA 1.453 -0.214 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -178.633 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 10.6 m . . . . . 0 C--O 1.242 0.702 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -176.838 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 118.783 -0.627 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -66.22 -36.58 83.43 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 177.168 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 17.4 m -84.32 135.43 41.47 Favored Pre-proline 0 C--N 1.324 -0.53 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 176.087 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.19 152.68 62.02 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 118.224 -0.717 . . . . 0.0 113.234 179.211 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.8 m -73.21 162.88 28.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.777 -178.709 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.403 HG13 HD23 ' A' ' 506' ' ' LEU . 56.0 t -54.61 -47.18 72.71 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.792 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.681 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -65.07 -33.78 76.86 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -178.53 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.11 -41.74 85.72 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.97 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -72.43 -32.73 66.55 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.863 -177.852 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -57.42 -39.17 75.64 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.306 -179.541 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -53.76 -38.84 64.82 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.969 -178.878 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -70.42 -55.38 9.19 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.444 176.424 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.9 -45.89 82.31 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -176.397 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 17.9 t-160 -62.02 -38.79 90.0 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.477 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 52.0 m -65.39 -41.31 93.81 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.357 178.696 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 7.1 mm-40 -63.81 -42.41 97.68 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 117.938 0.336 . . . . 0.0 111.255 178.742 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.52 -46.74 71.73 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 177.329 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 50.1 mtpt -68.14 -38.63 82.39 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.163 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -66.58 -32.68 74.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 177.934 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.78 -19.41 65.88 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 178.959 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 21.6 mt -104.11 12.1 34.36 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -56.47 129.44 40.73 Favored 'General case' 0 C--O 1.208 -1.114 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 178.126 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 57.0 t -62.41 -39.84 85.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 122.44 1.114 . . . . 0.0 108.242 177.229 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.36 -28.75 69.5 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 113.272 -1.786 . . . . 0.0 113.165 -179.506 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 95.9 p -163.03 76.68 1.87 Allowed Pre-proline 0 C--O 1.241 0.627 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.017 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.82 144.97 49.78 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 114.701 -3.066 . . . . 0.0 111.895 179.469 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -137.21 91.53 2.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.755 0.788 . . . . 0.0 110.228 -174.851 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.414 HG12 ' H ' ' A' ' 493' ' ' VAL . 1.0 OUTLIER -57.29 -45.65 85.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -177.636 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.72 -30.47 68.84 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -178.0 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -71.01 -41.64 70.65 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -178.501 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.476 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.23 -48.31 76.32 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.458 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 94.0 mt -57.64 -42.55 83.65 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 117.627 0.194 . . . . 0.0 111.464 -177.343 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -64.8 -39.1 93.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.3 0.572 . . . . 0.0 111.25 178.382 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -65.82 -48.67 70.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 177.995 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.476 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -58.53 -44.57 89.62 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.505 178.822 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.27 -33.18 75.22 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 119.086 0.857 . . . . 0.0 111.544 -177.085 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -50.85 37.52 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 106.074 -1.825 . . . . 0.0 106.074 175.065 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.27 -30.72 18.74 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.211 0.529 . . . . 0.0 112.308 -177.479 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.64 -28.03 73.21 Favored Glycine 0 C--O 1.24 0.501 0 N-CA-C 114.91 0.724 . . . . 0.0 114.91 177.608 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 9.0 t -100.36 -25.94 14.05 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.322 0.561 . . . . 0.0 110.67 -177.844 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.403 HD23 HG13 ' A' ' 471' ' ' VAL . 3.0 mp -56.11 137.11 52.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 O-C-N 121.789 -0.569 . . . . 0.0 112.389 174.825 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.449 ' O ' HD13 ' A' ' 512' ' ' ILE . 30.3 tt0 -78.97 80.23 5.33 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 122.588 1.185 . . . . 0.0 109.795 -179.422 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.817 HG21 HD22 ' A' ' 546' ' ' LEU . 30.9 m -93.33 49.76 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 CA-C-O 123.248 1.499 . . . . 0.0 108.081 -179.731 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.6 t -66.96 174.95 2.72 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 113.859 -1.518 . . . . 0.0 107.122 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 21.0 m -49.29 -36.16 20.05 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -173.577 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -53.72 -44.54 69.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 178.42 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.449 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -88.57 -40.29 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 -179.33 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.436 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.71 -39.81 81.89 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -176.261 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -68.89 -31.09 69.76 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.757 -0.202 . . . . 0.0 111.358 -178.375 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -90.04 -2.38 58.11 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 122.235 -0.291 . . . . 0.0 111.328 177.572 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -129.91 46.51 2.64 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.698 0.761 . . . . 0.0 111.802 179.046 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.2 p -64.6 -28.83 69.89 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 121.713 -0.617 . . . . 0.0 112.307 -179.29 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -65.41 -28.56 69.34 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.393 0.616 . . . . 0.0 111.715 177.851 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 59.5 t -68.9 -44.52 81.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.782 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 34.4 t -62.56 -36.36 74.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.211 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.6 -40.1 95.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 119.345 -0.36 . . . . 0.0 110.7 177.309 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 93.6 m -72.77 -39.71 66.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 118.704 0.684 . . . . 0.0 110.532 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.665 HD23 HD11 ' A' ' 526' ' ' ILE . 68.9 mt -57.76 -35.02 70.19 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.903 0.382 . . . . 0.0 111.133 178.828 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -65.41 -29.05 69.71 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.691 -0.631 . . . . 0.0 111.527 175.928 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -73.05 -46.03 54.09 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.022 0.439 . . . . 0.0 110.798 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.665 HD11 HD23 ' A' ' 523' ' ' LEU . 15.2 pt -77.39 -21.44 14.19 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 -175.843 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.469 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -62.49 -18.86 62.81 Favored 'General case' 0 C--O 1.212 -0.888 0 O-C-N 121.94 -0.475 . . . . 0.0 111.422 175.89 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.77 18.98 13.27 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 122.846 0.458 . . . . 0.0 111.101 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -63.04 119.95 10.47 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 122.612 0.365 . . . . 0.0 110.69 -178.479 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -88.45 -23.29 23.31 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 115.437 1.643 . . . . 0.0 115.437 -175.598 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.01 -41.22 91.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.245 0.545 . . . . 0.0 110.993 -177.641 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -130.8 112.64 13.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.91 -179.048 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -56.78 -43.65 81.06 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.889 179.086 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -55.79 -41.86 74.72 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -176.628 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.2 t -58.19 -43.33 85.45 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.092 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -64.17 -44.03 93.32 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 179.786 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -63.56 -48.91 75.52 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.958 -179.606 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -70.54 -39.04 74.23 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 118.717 -1.193 . . . . 0.0 111.132 -177.516 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.43 -39.56 83.93 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 121.355 0.598 . . . . 0.0 109.789 178.572 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.58 -46.2 83.74 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.28 -0.873 . . . . 0.0 113.172 178.745 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -40.42 90.67 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.006 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 55.6 t -70.68 -53.62 21.45 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.359 -178.793 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -53.94 -44.94 71.09 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 122.293 0.237 . . . . 0.0 110.734 -175.027 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 28.0 m -64.2 -38.79 92.33 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 123.203 0.601 . . . . 0.0 111.125 179.136 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 40.6 mtt85 -61.91 -30.65 71.04 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 121.748 -0.595 . . . . 0.0 110.909 176.923 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.817 HD22 HG21 ' A' ' 508' ' ' VAL . 5.8 mt -75.6 -31.73 60.05 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 -177.149 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -36.57 78.72 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.974 176.014 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.4 m -81.73 -15.05 55.6 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 177.02 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 90.2 mtt-85 -91.98 -18.39 23.74 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.916 -0.49 . . . . 0.0 111.761 -179.852 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -123.16 -172.35 13.83 Favored Glycine 0 C--O 1.226 -0.404 0 N-CA-C 109.876 -1.29 . . . . 0.0 109.876 -178.0 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.246 0.871 0 C-N-CA 124.548 1.139 . . . . 0.0 108.699 -177.383 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -74.29 166.07 24.09 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 177.29 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 22.9 t -144.71 142.37 18.91 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 177.662 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -67.46 152.74 78.27 Favored 'Trans proline' 0 C--O 1.241 0.632 0 C-N-CA 117.983 -0.878 . . . . 0.0 113.4 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.6 m -67.09 166.18 14.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.478 179.948 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.407 HG13 ' HB3' ' A' ' 506' ' ' LEU . 45.2 t -55.43 -46.17 78.53 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.047 0 O-C-N 122.212 -0.305 . . . . 0.0 111.543 179.095 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.418 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -64.69 -35.25 80.43 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -177.529 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.56 -42.08 87.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.84 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -69.22 -38.12 78.38 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 121.546 0.688 . . . . 0.0 109.503 -179.154 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.613 HD21 HG21 ' A' ' 519' ' ' VAL . 4.5 tt -57.73 -35.58 70.88 Favored 'General case' 0 C--O 1.209 -1.045 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.727 179.424 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -57.58 -41.31 80.89 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 119.366 0.984 . . . . 0.0 110.402 178.066 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -67.39 -53.22 31.19 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.721 178.427 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -45.22 88.81 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.892 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.464 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.0 t-160 -58.17 -44.8 88.15 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -179.846 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.1 m -62.69 -39.07 92.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 -179.125 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.415 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 13.3 mm-40 -64.11 -37.62 88.12 Favored 'General case' 0 CA--C 1.505 -0.764 0 C-N-CA 120.516 -0.473 . . . . 0.0 110.49 178.346 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.4 mt -59.09 -43.39 89.1 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.954 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 178.845 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -63.04 -45.32 92.81 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 122.127 -0.358 . . . . 0.0 111.855 -179.485 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -65.71 -33.24 75.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.734 0.302 . . . . 0.0 111.121 -178.524 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.15 -15.99 64.05 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 179.37 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 36.0 mt -111.87 12.1 20.82 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -177.914 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt -54.23 129.48 35.22 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 177.434 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.39 -40.33 83.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 122.73 1.253 . . . . 0.0 107.893 177.001 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.84 -24.63 64.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 112.959 -1.928 . . . . 0.0 113.348 179.944 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 7.1 m -159.58 71.74 3.3 Favored Pre-proline 0 N--CA 1.475 0.788 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -176.778 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -71.49 139.82 35.2 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 114.142 -3.438 . . . . 0.0 112.006 179.144 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -137.14 95.85 3.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.529 0.681 . . . . 0.0 111.583 -177.649 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.409 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.5 OUTLIER -55.12 -48.88 75.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -176.871 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 19.8 pttm -58.61 -32.55 69.11 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-O 122.533 1.159 . . . . 0.0 110.503 -175.566 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -67.86 -42.17 81.75 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.194 -178.144 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.4 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.8 -48.34 74.79 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.733 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 75.5 mt -56.76 -43.19 80.55 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -176.125 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -64.64 -38.77 92.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.639 0.733 . . . . 0.0 111.95 179.384 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.85 -44.87 69.0 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.468 0.652 . . . . 0.0 109.551 179.333 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.4 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.05 -49.8 72.73 Favored 'General case' 0 N--CA 1.428 -1.564 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.463 177.224 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -62.4 -34.86 77.56 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -175.376 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -67.8 -48.22 66.88 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 176.367 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -32.21 66.46 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.291 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.6 -15.66 66.64 Favored Glycine 0 N--CA 1.453 -0.222 0 CA-C-O 119.104 -0.831 . . . . 0.0 114.382 179.129 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.5 t -114.54 -13.72 12.16 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.482 1.141 . . . . 0.0 110.968 179.518 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.407 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.0 mt -67.29 148.25 51.93 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.818 -0.551 . . . . 0.0 110.558 179.472 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -77.83 84.41 4.14 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 122.738 1.256 . . . . 0.0 109.936 178.261 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.911 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -98.35 50.11 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-O 123.228 1.489 . . . . 0.0 109.138 -177.597 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.1 t -68.58 171.89 6.97 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 106.567 -1.642 . . . . 0.0 106.567 -179.195 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.28 -33.49 13.14 Favored 'General case' 0 C--O 1.218 -0.596 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -174.109 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -54.19 -44.39 71.51 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 111.441 0.163 . . . . 0.0 111.441 178.378 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.5 mp -88.52 -43.13 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-O 121.337 0.589 . . . . 0.0 110.088 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.526 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.9 -40.37 84.26 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -175.527 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -71.14 -28.64 64.43 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.136 -176.35 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -89.76 -5.55 56.85 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 122.332 -0.23 . . . . 0.0 111.169 176.903 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -127.44 42.55 3.3 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.854 0.835 . . . . 0.0 112.505 179.93 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 17.8 p -63.86 -24.01 67.58 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -179.264 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.54 -32.27 73.85 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.314 1.054 . . . . 0.0 112.213 178.293 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.613 HG21 HD21 ' A' ' 475' ' ' LEU . 61.3 t -69.6 -42.58 80.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 179.118 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 48.5 t -63.2 -37.47 79.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.079 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.41 -33.13 74.88 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.655 178.029 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.7 m -79.29 -39.38 33.08 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.904 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.526 HD23 HD11 ' A' ' 526' ' ' ILE . 40.7 mt -57.43 -34.7 69.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.985 0.421 . . . . 0.0 111.431 178.22 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -63.87 -29.2 70.41 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.781 -0.574 . . . . 0.0 111.568 175.157 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -74.77 -43.34 55.33 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.603 0.239 . . . . 0.0 111.611 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.526 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -78.78 -21.82 12.93 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.952 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -177.373 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.418 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -60.65 -17.91 50.3 Favored 'General case' 0 C--O 1.211 -0.924 0 O-C-N 122.032 -0.417 . . . . 0.0 112.091 176.357 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -118.71 19.35 13.21 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.053 0.541 . . . . 0.0 111.269 178.005 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -65.7 115.34 5.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.167 0.508 . . . . 0.0 111.46 -176.968 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -82.91 -23.6 33.46 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 -176.488 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.54 -40.33 92.78 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.972 -177.093 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -133.22 113.23 12.43 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.87 -178.773 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.1 tptt -56.05 -44.66 79.06 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.565 178.728 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -55.32 -43.15 74.65 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -176.731 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 76.0 t -57.91 -43.93 85.56 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 177.477 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -62.97 -44.69 95.36 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 119.333 -0.365 . . . . 0.0 110.04 179.414 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.91 -47.51 77.5 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.5 tptt -69.33 -39.24 78.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.115 -1.034 . . . . 0.0 111.28 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.92 85.94 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.263 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.418 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.73 -48.82 75.47 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.774 -1.103 . . . . 0.0 113.142 178.863 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -43.32 92.6 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.841 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 78.8 t -68.94 -50.55 53.06 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.877 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.162 -178.416 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -55.03 -43.86 74.09 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.611 0.243 . . . . 0.0 110.446 -177.692 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 16.5 m -67.57 -35.82 79.74 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 122.641 0.377 . . . . 0.0 111.123 179.265 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.52 -31.85 69.77 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 176.182 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.911 HD22 HG21 ' A' ' 508' ' ' VAL . 5.5 mt -75.08 -36.73 61.72 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -176.327 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -56.45 -37.68 70.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.629 179.429 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 13.8 m -75.12 -8.5 56.75 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 178.421 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -114.6 -30.04 6.63 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -176.858 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -162.47 35.13 0.34 Allowed Glycine 0 C--O 1.233 0.08 0 C-N-CA 120.893 -0.67 . . . . 0.0 114.017 -178.978 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 29.8 m . . . . . 0 C--O 1.25 1.091 0 C-N-CA 123.72 0.808 . . . . 0.0 111.686 -177.239 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -73.26 162.57 29.22 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 176.873 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 22.7 m -73.79 138.63 76.76 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.677 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.83 148.74 58.8 Favored 'Trans proline' 0 C--O 1.239 0.541 0 C-N-CA 117.742 -1.039 . . . . 0.0 113.645 -179.413 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.4 m -68.54 164.28 21.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.784 179.46 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 471' ' ' VAL . . . . . 0.427 HG13 ' HB3' ' A' ' 506' ' ' LEU . 32.7 t -53.89 -47.6 63.92 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 O-C-N 122.007 -0.433 . . . . 0.0 111.97 179.399 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -62.31 -33.68 75.13 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.428 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -67.28 -40.8 86.16 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -179.565 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -74.21 -35.58 63.92 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.409 -178.034 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.622 HD21 HG21 ' A' ' 519' ' ' VAL . 3.7 tt -58.63 -37.2 75.39 Favored 'General case' 0 C--O 1.206 -1.197 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.237 178.369 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -59.07 -40.85 86.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 119.036 0.835 . . . . 0.0 110.61 178.422 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -64.82 -53.13 51.7 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.789 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -44.57 93.89 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.079 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.424 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.4 t-160 -57.9 -44.79 86.99 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -178.898 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.7 m -62.77 -39.63 94.8 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.181 0.301 . . . . 0.0 111.622 -179.325 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -64.41 -37.25 86.86 Favored 'General case' 0 CA--C 1.504 -0.81 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.625 178.337 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.8 mt -59.14 -43.47 89.48 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.031 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 178.872 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.7 mmtt -63.68 -46.02 87.43 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.37 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -64.81 -33.04 75.05 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 120.8 0.333 . . . . 0.0 111.16 -178.246 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.59 -17.55 64.67 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 179.958 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.2 mt -111.89 12.05 20.8 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -177.091 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -66.76 133.38 50.02 Favored 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 179.932 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 40.4 t -56.89 -39.14 63.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-O 122.079 0.942 . . . . 0.0 111.326 -177.246 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -63.02 -30.24 71.44 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 113.978 -1.465 . . . . 0.0 113.381 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 2.2 m -164.53 78.62 1.43 Allowed Pre-proline 0 N--CA 1.479 0.986 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.399 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.96 147.52 61.75 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 115.732 -2.379 . . . . 0.0 112.339 177.862 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -137.3 99.57 4.01 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.672 0.748 . . . . 0.0 110.118 -179.386 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.22 -47.26 84.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.355 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.94 -32.62 67.97 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 121.99 0.9 . . . . 0.0 109.989 -176.74 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -69.52 -41.37 76.09 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.268 -1.333 . . . . 0.0 108.933 -176.543 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.405 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.57 -49.81 67.48 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 176.096 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 81.2 mt -56.45 -43.07 79.16 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.286 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.35 -38.27 90.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.64 0.733 . . . . 0.0 112.07 -179.931 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -72.1 -44.81 62.64 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.722 -0.612 . . . . 0.0 109.642 178.449 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.405 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.59 -48.09 72.55 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.542 177.205 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -62.55 -35.76 80.48 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -176.17 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -67.84 -48.97 64.69 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.395 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.66 -33.63 64.25 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.88 -179.526 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.71 -17.77 69.49 Favored Glycine 0 C--O 1.236 0.276 0 N-CA-C 115.165 0.826 . . . . 0.0 115.165 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.9 t -111.08 -12.77 14.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.064 0.932 . . . . 0.0 110.484 -179.584 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 506' ' ' LEU . . . . . 0.427 ' HB3' HG13 ' A' ' 471' ' ' VAL . 5.2 mt -67.71 148.15 51.69 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.979 -0.451 . . . . 0.0 110.462 -179.884 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.417 ' O ' HD13 ' A' ' 512' ' ' ILE . 37.4 tt0 -78.59 84.46 4.71 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-O 122.841 1.305 . . . . 0.0 109.078 177.655 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.876 HG21 HD22 ' A' ' 546' ' ' LEU . 30.3 m -99.97 48.37 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 CA-C-O 123.087 1.422 . . . . 0.0 108.477 -177.875 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.4 t -67.06 172.45 4.55 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 -179.602 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 24.1 m -49.23 -32.19 10.14 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -174.419 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -54.48 -44.95 73.08 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 178.169 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.417 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -88.68 -42.6 14.79 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 CA-C-O 121.261 0.553 . . . . 0.0 109.656 179.388 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.523 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.85 -40.07 83.16 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 -175.196 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -70.53 -28.95 65.33 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.192 -176.875 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -90.54 -4.25 57.03 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 122.364 -0.21 . . . . 0.0 111.171 177.23 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -128.24 43.02 3.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.674 0.75 . . . . 0.0 112.361 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.7 p -63.44 -24.34 67.79 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -178.833 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.64 -30.61 71.34 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.527 0.679 . . . . 0.0 112.158 178.077 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.622 HG21 HD21 ' A' ' 475' ' ' LEU . 42.7 t -71.18 -41.55 75.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 107.262 -1.385 . . . . 0.0 107.262 178.402 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 38.1 t -62.99 -37.67 79.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.616 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.08 -34.52 78.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.447 177.7 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.7 m -77.1 -39.76 48.39 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.668 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.54 HD23 HD11 ' A' ' 526' ' ' ILE . 47.0 mt -58.36 -35.52 72.08 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.261 0.553 . . . . 0.0 110.933 178.87 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.56 -29.08 70.1 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.998 -0.439 . . . . 0.0 111.343 175.246 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -72.91 -45.33 58.73 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 117.839 0.29 . . . . 0.0 111.472 178.391 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.54 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -77.66 -21.68 13.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -176.215 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.424 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.2 OUTLIER -61.19 -18.32 57.65 Favored 'General case' 0 C--O 1.211 -0.958 0 O-C-N 122.132 -0.355 . . . . 0.0 111.895 176.452 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -118.74 19.45 13.16 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.025 0.53 . . . . 0.0 112.042 176.537 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.405 ' CE2' ' HB3' ' A' ' 531' ' ' ALA . 11.2 t80 -60.96 118.18 6.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.236 0.541 . . . . 0.0 112.24 -177.263 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -74.04 -33.18 63.64 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 -176.672 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.405 ' HB3' ' CE2' ' A' ' 529' ' ' TYR . . . -67.01 -41.9 85.86 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -172.975 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -131.91 117.2 18.16 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 122.314 -0.241 . . . . 0.0 110.867 -177.811 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.4 tptt -57.7 -46.63 84.08 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.517 178.165 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -55.64 -42.66 75.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -176.383 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 72.2 t -56.73 -44.47 81.6 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.521 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 177.242 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.9 ttp -64.29 -43.86 93.45 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 119.151 -0.452 . . . . 0.0 110.036 179.435 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -64.7 -47.32 78.78 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.377 -0.529 . . . . 0.0 112.092 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -69.65 -39.14 77.25 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 119.148 -1.021 . . . . 0.0 111.104 -179.138 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.1 -39.92 83.71 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.414 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.88 -49.54 70.08 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.922 -1.036 . . . . 0.0 113.18 179.081 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -42.6 91.25 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.983 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.8 t -70.6 -50.09 47.42 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.464 -177.93 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -55.35 -45.11 76.46 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -177.999 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.6 m -66.75 -34.77 78.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.399 0.618 . . . . 0.0 111.186 179.55 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 12.3 mtt85 -60.71 -29.77 69.54 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.864 -0.522 . . . . 0.0 109.967 175.027 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.876 HD22 HG21 ' A' ' 508' ' ' VAL . 8.8 mt -76.52 -35.3 58.39 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -176.134 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.81 -28.93 70.34 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.03 178.902 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 22.1 m -78.7 -8.59 58.85 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.718 -1.128 . . . . 0.0 111.905 178.385 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -115.4 -26.65 7.48 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.44 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -164.57 161.78 34.88 Favored Glycine 0 C--O 1.237 0.287 0 C-N-CA 121.522 -0.371 . . . . 0.0 112.443 -177.974 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 12.6 m . . . . . 0 C--O 1.241 0.655 0 CA-C-O 117.758 -1.115 . . . . 0.0 112.642 -177.909 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.955 0 CA-C-O 118.621 -0.704 . . . . 0.0 109.815 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 68.4 -38.64 0.38 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 125.53 1.532 . . . . 0.0 112.738 -175.704 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 53.3 m -140.4 154.44 69.6 Favored Pre-proline 0 C--O 1.243 0.735 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 174.133 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -72.26 152.6 55.92 Favored 'Trans proline' 0 C--O 1.243 0.729 0 O-C-N 122.212 0.585 . . . . 0.0 113.561 179.259 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.5 m -72.13 168.94 17.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.263 179.305 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 56.7 t -57.37 -46.41 85.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.022 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.432 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.414 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.3 pt-20 -65.49 -34.16 77.63 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.572 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -65.24 -42.86 92.92 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 177.393 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -70.05 -34.61 73.45 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.041 -179.201 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -57.55 -40.43 78.88 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.356 -178.552 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -55.01 -40.09 69.77 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.579 -179.213 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 53.3 tttt -67.94 -57.77 5.64 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.503 -0.184 . . . . 0.0 110.503 176.744 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -45.52 89.02 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -176.126 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -60.0 -42.28 93.92 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -179.325 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 61.8 m -62.64 -39.67 94.6 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.998 -179.218 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.415 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.6 mm-40 -63.72 -37.85 88.89 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.077 178.431 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -60.08 -42.53 90.24 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.022 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.368 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -64.81 -45.12 87.6 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 122.182 -0.324 . . . . 0.0 111.568 -179.452 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -66.2 -30.44 70.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.192 -178.185 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.73 -18.19 64.81 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 178.604 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 35.2 mt -107.66 12.21 27.76 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -177.985 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -55.23 135.87 49.25 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-O 121.697 0.761 . . . . 0.0 109.914 178.124 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 13.0 m -73.49 -21.45 18.63 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.149 178.877 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.58 -31.18 47.11 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 113.798 -1.546 . . . . 0.0 111.251 -178.873 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 43.5 t -168.8 83.41 0.69 Allowed Pre-proline 0 C--O 1.238 0.483 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.912 -175.831 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.35 146.45 50.66 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 115.447 -2.569 . . . . 0.0 111.964 178.014 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -137.18 100.12 4.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.857 0.837 . . . . 0.0 111.419 -178.839 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.443 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.6 OUTLIER -58.85 -44.2 90.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.959 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -60.65 -31.82 71.02 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -177.849 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -71.53 -41.81 68.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.1 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.435 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -63.94 -48.61 75.83 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.407 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 71.4 mt -56.87 -43.88 81.66 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -176.715 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -65.35 -38.72 90.95 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.322 0.582 . . . . 0.0 111.326 -179.658 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.24 -47.13 71.7 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.425 0.631 . . . . 0.0 109.463 178.631 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.435 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.09 -42.2 80.27 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.054 178.085 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -62.8 -37.93 88.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 119.094 0.861 . . . . 0.0 112.579 -177.942 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -70.93 -44.09 66.87 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.91 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -32.92 66.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.522 0.677 . . . . 0.0 110.738 179.164 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.53 -16.97 66.13 Favored Glycine 0 C--O 1.239 0.433 0 CA-C-O 119.165 -0.797 . . . . 0.0 114.749 -179.84 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.5 t -113.74 -15.37 12.46 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.15 0.975 . . . . 0.0 111.227 -179.766 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.0 mt -64.94 145.24 56.58 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.98 -0.45 . . . . 0.0 110.813 179.734 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.426 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.3 tt0 -79.62 84.29 5.49 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 122.531 1.158 . . . . 0.0 109.653 178.168 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.954 HG21 HD22 ' A' ' 546' ' ' LEU . 27.0 m -96.44 48.18 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-O 123.214 1.483 . . . . 0.0 108.21 -178.705 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.7 t -68.16 172.99 5.06 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 -178.296 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.6 m -49.29 -31.65 9.41 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -173.643 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -55.43 -44.59 76.44 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 177.015 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.426 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -88.66 -42.18 14.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.566 0 CA-C-O 121.72 0.772 . . . . 0.0 109.1 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.424 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -57.47 -40.5 78.71 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -175.591 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -69.71 -31.3 69.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.15 -177.455 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -89.29 -5.14 57.81 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.233 178.31 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -128.94 45.03 2.86 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.43 0.633 . . . . 0.0 112.19 -179.652 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 25.2 p -65.08 -26.76 68.37 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -179.375 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -63.39 -27.25 69.17 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.918 0.866 . . . . 0.0 111.992 177.799 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 55.0 t -70.65 -45.69 72.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 179.549 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.4 -36.99 78.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 179.052 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.4 -36.36 82.08 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.861 177.42 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 61.4 m -76.26 -40.54 51.63 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 118.182 0.446 . . . . 0.0 110.457 179.445 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.717 HD23 HD11 ' A' ' 526' ' ' ILE . 61.4 mt -57.97 -35.12 70.71 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.051 0.453 . . . . 0.0 111.087 178.85 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -63.86 -29.0 70.23 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.9 -0.5 . . . . 0.0 111.452 175.733 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -73.19 -46.46 50.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.787 0.327 . . . . 0.0 111.31 178.81 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.717 HD11 HD23 ' A' ' 523' ' ' LEU . 7.7 pt -77.12 -21.18 14.4 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -175.983 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.445 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.28 -14.7 52.52 Favored 'General case' 0 C--O 1.213 -0.842 0 O-C-N 121.746 -0.596 . . . . 0.0 112.282 175.786 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -118.86 17.78 13.37 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 122.48 0.312 . . . . 0.0 111.233 175.69 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 529' ' ' TYR . . . . . 0.418 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 10.1 t80 -62.88 126.16 26.4 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.957 0.408 . . . . 0.0 110.856 -177.071 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -92.43 -24.95 18.68 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -176.437 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 531' ' ' ALA . . . . . 0.418 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -64.82 -39.81 94.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.155 0.502 . . . . 0.0 110.965 -176.963 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -133.64 121.09 21.51 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.055 -179.405 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -60.26 -44.02 95.65 Favored 'General case' 0 C--O 1.211 -0.963 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.875 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.69 -43.98 76.92 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -175.401 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.6 t -58.39 -44.65 89.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.136 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.8 ttp -64.94 -43.29 93.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.106 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.43 -48.9 75.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 179.353 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 40.2 tptt -71.66 -37.72 70.76 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 118.493 -1.283 . . . . 0.0 111.19 -177.518 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 539' ' ' ALA . . . . . 0.425 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -58.2 -40.73 82.33 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-O 121.785 0.802 . . . . 0.0 108.952 178.363 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.445 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.75 -50.81 69.6 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.219 -1.355 . . . . 0.0 113.84 178.756 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.47 -43.67 89.01 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 -179.381 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.21 -52.62 41.01 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -177.134 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -53.98 -44.05 70.48 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.598 0.359 . . . . 0.0 110.551 -177.416 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 50.8 m -64.07 -38.52 91.37 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 123.844 0.858 . . . . 0.0 111.681 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -64.41 -28.5 69.72 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 121.552 -0.717 . . . . 0.0 110.781 176.734 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.954 HD22 HG21 ' A' ' 508' ' ' VAL . 7.2 mt -74.39 -35.62 63.49 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.027 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -57.72 -39.48 77.37 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.165 177.413 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 22.9 t -73.02 -17.23 61.47 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 178.947 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 73.1 mtt85 -98.62 -12.38 21.17 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.929 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -160.4 -87.89 0.07 OUTLIER Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.403 -177.18 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 C--O 1.25 1.106 0 N-CA-C 105.178 -2.156 . . . . 0.0 105.178 -178.96 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.899 0 CA-C-O 118.564 -0.731 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -67.21 -36.62 82.09 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 175.975 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 19.8 m -91.85 149.33 38.82 Favored Pre-proline 0 C--O 1.243 0.759 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 175.044 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.44 147.56 71.45 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 118.091 -0.806 . . . . 0.0 113.37 179.42 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 7.1 m -72.79 167.45 20.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.26 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -54.79 -45.83 74.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 O-C-N 121.894 -0.504 . . . . 0.0 111.578 179.516 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.417 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.9 OUTLIER -62.48 -31.58 72.34 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.021 -178.854 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -73.5 -42.14 62.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 122.138 0.97 . . . . 0.0 108.405 179.384 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -70.33 -32.71 70.56 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.379 -177.628 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.415 ' C ' HD13 ' A' ' 475' ' ' LEU . 1.9 tm? -55.05 -40.21 70.04 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.358 178.842 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -54.23 -40.6 67.85 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.686 -178.268 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -69.54 -53.2 20.14 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.314 177.75 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -46.86 86.56 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -178.742 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -60.25 -43.67 95.91 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -179.465 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 69.0 m -60.24 -38.71 84.28 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 118.01 0.368 . . . . 0.0 111.124 -179.83 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -65.71 -36.34 83.34 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 120.159 -0.617 . . . . 0.0 110.978 177.549 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 89.1 mt -61.46 -43.12 96.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 178.696 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -62.18 -45.87 91.48 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 179.825 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -66.5 -34.23 77.45 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.747 0.308 . . . . 0.0 111.207 -178.368 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.35 -18.95 65.13 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 179.677 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.8 mt -108.2 12.15 26.86 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.573 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 8.5 mttm -56.82 131.6 49.87 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 176.869 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 14.5 m -72.7 -20.39 19.3 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.634 -179.329 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.7 -30.74 41.13 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 113.779 -1.555 . . . . 0.0 110.921 -178.951 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 25.0 t -166.27 85.8 0.92 Allowed Pre-proline 0 C--O 1.239 0.512 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.418 -177.977 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.81 149.56 48.21 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 117.314 -1.324 . . . . 0.0 112.415 178.477 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -137.29 93.39 2.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.589 0.709 . . . . 0.0 110.183 -177.246 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.417 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.8 OUTLIER -58.4 -47.34 88.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 -177.438 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 26.5 pttt -58.77 -31.4 68.34 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-O 121.696 0.76 . . . . 0.0 110.347 -176.38 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.0 ttm-85 -68.81 -43.33 75.81 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.227 -178.673 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.438 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -63.24 -48.81 76.68 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.556 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.9 mt -57.48 -42.79 83.34 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -176.762 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -65.53 -38.58 90.07 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.54 0.686 . . . . 0.0 111.495 179.163 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.69 -47.07 70.48 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.034 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.438 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.88 -45.58 82.46 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.206 178.859 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -64.75 -34.63 78.78 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -176.486 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -44.11 66.42 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 176.282 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.79 -35.6 66.47 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.28 0.562 . . . . 0.0 110.898 179.429 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.46 -18.65 69.97 Favored Glycine 0 C--O 1.239 0.448 0 N-CA-C 114.762 0.665 . . . . 0.0 114.762 -179.858 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 12.7 t -109.31 -12.4 14.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.917 0.858 . . . . 0.0 110.581 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -68.78 146.25 53.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.163 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -80.35 80.58 6.76 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-O 122.508 1.147 . . . . 0.0 109.031 178.144 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.881 HG21 HD22 ' A' ' 546' ' ' LEU . 29.3 m -94.3 48.17 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 123.071 1.415 . . . . 0.0 107.576 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.68 173.62 3.35 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.709 -177.978 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 34.3 m -48.46 -35.33 12.73 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.517 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -55.52 -44.34 76.58 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.267 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -87.62 -38.71 12.25 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.397 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -179.41 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.418 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.21 -37.74 81.2 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -176.749 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -66.27 -33.73 76.4 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.567 0.222 . . . . 0.0 111.426 -179.553 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -89.35 -3.29 58.52 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 121.076 -0.25 . . . . 0.0 111.316 179.172 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -128.12 43.42 3.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.875 0.845 . . . . 0.0 112.398 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -64.17 -28.56 69.84 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 121.722 -0.611 . . . . 0.0 112.466 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -70.53 -24.26 62.78 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.501 0.667 . . . . 0.0 112.034 179.176 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 86.7 t -70.87 -43.82 76.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 106.152 -1.796 . . . . 0.0 106.152 177.302 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 49.5 t -62.53 -35.62 70.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 178.244 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.99 -35.93 81.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 119.042 -0.504 . . . . 0.0 111.645 177.318 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.5 m -77.06 -39.17 50.87 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.165 0.893 . . . . 0.0 108.734 179.32 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.545 HD23 HD11 ' A' ' 526' ' ' ILE . 34.9 mt -57.5 -35.01 69.69 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.813 0.34 . . . . 0.0 111.664 179.019 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -63.3 -29.12 70.5 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.878 -0.513 . . . . 0.0 111.392 175.623 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -76.49 -46.24 27.6 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.657 0.265 . . . . 0.0 111.708 -179.422 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.545 HD11 HD23 ' A' ' 523' ' ' LEU . 1.1 pt -74.77 -23.57 17.78 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.932 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -176.929 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.455 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 1.7 mtm180 -59.94 -20.65 58.67 Favored 'General case' 0 C--O 1.214 -0.788 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 176.152 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -119.51 19.41 12.66 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.976 0.51 . . . . 0.0 111.48 178.854 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -62.03 117.91 6.59 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 121.063 0.458 . . . . 0.0 111.355 -177.564 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -79.49 -26.59 41.59 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -176.475 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.14 -40.93 86.84 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.692 -0.403 . . . . 0.0 112.081 -175.354 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -131.55 117.0 18.16 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -178.464 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -59.05 -43.62 91.7 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.617 179.039 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -57.79 -42.24 83.76 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.062 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -57.53 -43.12 82.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 O-C-N 121.809 -0.557 . . . . 0.0 109.542 177.454 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -43.03 94.36 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 178.559 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -63.87 -49.28 73.39 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.121 0.263 . . . . 0.0 110.476 -178.336 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -70.88 -40.63 72.13 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.958 -178.222 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.14 -38.77 80.47 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.14 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.455 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.79 -50.17 70.05 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 177.757 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.68 -42.15 83.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 77.0 t -70.44 -52.06 32.59 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.859 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.135 -178.618 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -54.48 -44.47 72.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.641 0.258 . . . . 0.0 110.412 -177.171 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 24.8 m -65.25 -38.43 90.33 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 122.909 0.483 . . . . 0.0 111.022 179.358 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 44.1 mtt180 -59.99 -30.71 69.31 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 121.838 -0.539 . . . . 0.0 110.752 176.573 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.881 HD22 HG21 ' A' ' 508' ' ' VAL . 3.8 mt -76.24 -30.88 58.08 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 -176.782 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.11 -37.95 89.23 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.899 177.575 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.7 m -76.81 -15.03 59.84 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 177.982 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -96.92 -11.09 25.13 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 122.154 -0.341 . . . . 0.0 110.811 178.358 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -105.58 -176.2 24.05 Favored Glycine 0 N--CA 1.451 -0.323 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 -177.04 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.257 1.473 0 CA-C-O 116.158 -1.877 . . . . 0.0 108.325 -177.038 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -71.84 154.08 41.5 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 177.113 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 25.1 m -73.31 144.99 84.96 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 178.278 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.07 165.66 30.59 Favored 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 118.419 -0.587 . . . . 0.0 112.491 177.717 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 15.0 m -60.92 159.73 10.88 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -178.029 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 22.4 t -53.0 -47.04 54.47 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.122 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 178.841 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.424 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.1 OUTLIER -63.74 -34.19 77.33 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.585 -177.252 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -68.76 -40.5 79.71 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 122.464 1.126 . . . . 0.0 108.526 179.42 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -73.34 -34.86 65.88 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.1 -177.731 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.571 HD21 HG21 ' A' ' 519' ' ' VAL . 4.5 tt -58.42 -36.14 73.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.054 179.408 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -54.18 -43.13 70.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 118.456 0.571 . . . . 0.0 109.862 178.325 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -67.82 -56.32 9.6 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.556 178.372 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -44.99 81.16 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.333 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 479' ' ' HIS . . . . . 0.441 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.4 t-160 -58.52 -43.56 89.21 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 179.166 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.5 m -64.74 -37.85 88.99 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 179.495 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.465 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.8 mm-40 -63.38 -38.14 90.01 Favored 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.05 178.307 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.11 -44.25 87.03 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.535 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.4 mmtt -62.52 -46.3 89.04 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -179.514 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -64.6 -33.59 76.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.871 0.367 . . . . 0.0 111.159 -178.243 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.84 -18.21 65.18 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 179.371 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 486' ' ' LEU . . . . . 0.409 HD11 ' CG2' ' A' ' 526' ' ' ILE . 26.1 mt -108.07 12.15 27.08 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.112 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -56.12 127.81 32.43 Favored 'General case' 0 CA--C 1.493 -1.219 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 176.527 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 29.6 m -70.25 -20.48 22.87 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.211 178.536 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -80.97 -27.41 36.0 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.155 -1.384 . . . . 0.0 111.091 177.864 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 4.2 m -160.81 75.62 2.63 Favored Pre-proline 0 N--CA 1.473 0.676 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.612 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -74.35 143.35 31.31 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 113.523 -3.851 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -137.25 98.19 3.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.788 0.804 . . . . 0.0 109.734 -178.65 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.44 -45.51 93.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.509 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -59.55 -31.05 69.06 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 -178.362 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -70.37 -41.29 73.3 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.762 -0.775 . . . . 0.0 108.96 -178.1 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.48 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.03 -48.35 76.66 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 175.889 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 96.7 mt -57.27 -43.18 82.87 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -176.719 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -64.58 -39.03 93.0 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.532 0.682 . . . . 0.0 111.3 178.677 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -65.74 -48.5 71.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.648 0.737 . . . . 0.0 109.695 178.599 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.48 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -57.86 -48.27 80.3 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.997 178.641 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -62.94 -33.07 74.57 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 119.847 -0.741 . . . . 0.0 112.803 -175.631 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.35 -48.65 40.18 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.44 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -30.67 42.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.801 0.81 . . . . 0.0 110.155 -178.849 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -63.85 -23.6 67.57 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 115.846 1.098 . . . . 0.0 115.846 176.821 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 9.0 t -104.88 -26.48 12.2 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 117.883 0.841 . . . . 0.0 110.367 178.766 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.2 mp -57.0 140.5 48.82 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 176.058 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -76.99 84.41 3.51 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 122.339 1.066 . . . . 0.0 110.692 -178.914 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.585 ' CG2' HD22 ' A' ' 546' ' ' LEU . 16.6 m -103.42 68.95 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 CA-C-O 126.794 3.188 . . . . 0.0 105.489 178.039 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.0 t -80.41 173.73 12.31 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 109.892 -3.322 . . . . 0.0 105.204 172.636 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.2 m -49.36 -36.73 22.4 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -175.365 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -54.29 -43.77 71.35 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -179.017 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.0 mp -88.56 -38.98 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.801 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 -178.03 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 4.8 mt -61.61 -39.4 91.12 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -175.886 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -68.82 -31.0 69.67 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.193 -0.203 . . . . 0.0 110.644 -177.861 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -87.27 -7.04 58.28 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 121.122 -0.231 . . . . 0.0 111.073 176.781 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -129.6 45.77 2.75 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.545 0.688 . . . . 0.0 112.11 179.194 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -63.89 -25.95 68.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.877 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.07 -29.03 69.3 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.846 0.831 . . . . 0.0 112.337 178.556 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 519' ' ' VAL . . . . . 0.571 HG21 HD21 ' A' ' 475' ' ' LEU . 65.0 t -71.08 -45.01 74.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 178.553 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 57.2 t -61.0 -38.1 78.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.149 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.25 -38.95 92.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.88 177.612 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 95.3 m -71.94 -38.69 69.79 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 118.371 0.532 . . . . 0.0 109.961 -178.613 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.634 HD23 HD11 ' A' ' 526' ' ' ILE . 63.3 mt -58.63 -34.89 71.69 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.116 0.484 . . . . 0.0 111.461 179.422 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -67.26 -29.13 68.67 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 121.613 -0.679 . . . . 0.0 111.012 176.27 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -71.52 -42.1 68.37 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.725 0.298 . . . . 0.0 111.151 179.861 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.634 HD11 HD23 ' A' ' 523' ' ' LEU . 6.0 pt -78.65 -23.28 13.12 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.266 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.539 ' HD2' ' HA ' ' A' ' 540' ' ' ALA . 7.4 mtp180 -64.69 -13.31 53.84 Favored 'General case' 0 C--O 1.217 -0.638 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 175.655 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.89 18.47 13.25 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.947 0.499 . . . . 0.0 111.544 175.07 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -66.47 118.07 9.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 112.044 -177.677 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -81.81 -26.64 34.18 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -177.573 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.54 -29.87 68.54 Favored 'General case' 0 C--O 1.219 -0.512 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -175.151 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -144.69 118.88 9.48 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.415 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -61.76 -46.58 88.95 Favored 'General case' 0 C--O 1.213 -0.86 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.452 -178.626 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -56.04 -38.96 71.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.17 0.509 . . . . 0.0 112.109 -175.175 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.8 t -55.96 -45.31 80.07 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 O-C-N 122.076 -0.39 . . . . 0.0 110.111 177.539 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -68.06 -40.78 82.69 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.754 178.432 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.09 -47.98 80.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 119.303 0.956 . . . . 0.0 111.567 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.7 tptt -72.18 -37.91 69.21 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 119.076 -1.049 . . . . 0.0 111.378 -178.741 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 539' ' ' ALA . . . . . 0.412 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -59.08 -38.06 78.56 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.254 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.539 ' HA ' ' HD2' ' A' ' 527' ' ' ARG . . . -66.63 -49.97 64.52 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.358 179.275 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -42.48 83.59 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.886 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 75.3 t -70.59 -53.45 22.37 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.262 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.965 -177.887 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 69.9 t80 -53.81 -46.97 71.26 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.184 0.516 . . . . 0.0 110.312 -176.011 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 27.8 m -60.07 -38.15 82.01 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.38 0.672 . . . . 0.0 112.343 178.286 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -65.21 -27.41 68.66 Favored 'General case' 0 C--N 1.32 -0.709 0 O-C-N 121.419 -0.801 . . . . 0.0 111.785 176.749 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.585 HD22 ' CG2' ' A' ' 508' ' ' VAL . 9.7 mt -75.59 -35.77 60.49 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -174.651 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -33.95 73.55 Favored 'General case' 0 C--O 1.205 -1.273 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.67 176.704 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 45.3 t -68.89 -43.46 75.22 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.315 175.019 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 80.8 mtt85 -72.09 -28.42 63.29 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 -178.469 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -118.99 8.63 12.5 Favored Glycine 0 C--N 1.323 -0.168 0 CA-C-O 118.815 -0.992 . . . . 0.0 115.411 -175.676 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 24.1 m . . . . . 0 C--O 1.244 0.772 0 O-C-N 124.555 0.797 . . . . 0.0 110.378 -175.513 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -66.53 147.6 53.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 177.756 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 40.6 m -126.38 71.59 71.63 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 123.187 0.305 . . . . 0.0 110.296 178.859 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.95 153.84 67.62 Favored 'Trans proline' 0 C--O 1.238 0.483 0 N-CA-C 114.213 0.813 . . . . 0.0 114.213 -178.185 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.1 m -67.7 162.76 23.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.073 -179.793 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.6 t -54.21 -44.19 63.64 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.38 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -66.92 -33.18 75.02 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 120.762 0.315 . . . . 0.0 111.721 -178.274 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.18 -39.98 82.38 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.675 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -73.72 -32.18 63.76 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.935 -177.242 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.426 HD23 HD21 ' A' ' 503' ' ' LEU . 1.6 tm? -54.58 -38.96 67.33 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.253 178.833 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -53.18 -38.71 63.06 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 121.321 -0.151 . . . . 0.0 111.264 -178.693 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -67.83 -57.67 5.89 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.568 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.88 -46.22 90.0 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -174.526 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -58.92 -43.16 91.08 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -179.501 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 67.0 m -63.28 -40.4 97.28 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 117.869 0.304 . . . . 0.0 111.213 -178.935 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.466 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.9 mm-40 -63.57 -37.52 87.65 Favored 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 120.671 -0.411 . . . . 0.0 111.149 178.862 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 94.3 mt -59.9 -44.06 93.52 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.989 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.168 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 49.2 mmtt -62.67 -44.67 95.66 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 122.153 -0.342 . . . . 0.0 111.919 -179.746 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -65.13 -33.88 77.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.781 0.324 . . . . 0.0 111.073 -178.189 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.89 -16.55 64.39 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 179.249 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 38.4 mt -111.08 12.24 21.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.868 -177.459 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -55.44 129.4 38.56 Favored 'General case' 0 C--O 1.21 -1.011 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 176.665 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.9 t -62.62 -39.75 85.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 122.16 0.981 . . . . 0.0 108.446 178.507 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.12 -28.07 64.04 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.066 -1.425 . . . . 0.0 113.414 -178.021 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.1 t -159.48 76.38 3.06 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -177.593 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -75.33 146.6 31.68 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 117.495 -1.203 . . . . 0.0 113.812 179.516 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -137.37 101.64 4.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.31 0.576 . . . . 0.0 111.397 178.575 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 493' ' ' VAL . . . . . 0.447 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.3 OUTLIER -56.58 -46.17 82.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -179.429 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 15.0 pttt -58.77 -32.2 69.06 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 121.857 0.837 . . . . 0.0 109.791 -176.478 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -70.83 -40.48 72.41 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.391 -1.277 . . . . 0.0 108.888 -176.476 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.437 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.51 -49.7 68.02 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 175.624 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.6 mt -56.91 -43.1 81.04 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.256 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -66.01 -37.08 84.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.467 0.651 . . . . 0.0 111.625 179.997 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.466 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.84 -47.71 68.21 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.772 0.796 . . . . 0.0 109.316 177.702 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.437 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.71 -44.97 82.07 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.77 178.632 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -60.57 -36.8 79.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 119.036 0.835 . . . . 0.0 112.673 -177.165 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -73.77 -42.64 60.74 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 178.69 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.426 HD21 HD23 ' A' ' 475' ' ' LEU . 0.5 OUTLIER -58.91 -34.29 71.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.164 0.507 . . . . 0.0 110.637 -179.436 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.1 -17.67 66.0 Favored Glycine 0 C--O 1.241 0.565 0 N-CA-C 114.848 0.699 . . . . 0.0 114.848 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.8 t -110.69 -14.7 13.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 117.699 0.75 . . . . 0.0 110.587 -179.131 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.2 mt -67.44 145.86 54.58 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.489 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.456 ' O ' HD13 ' A' ' 512' ' ' ILE . 30.3 tt0 -79.16 84.3 5.14 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 122.53 1.157 . . . . 0.0 109.797 178.37 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.947 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -96.8 48.5 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 CA-C-O 123.351 1.548 . . . . 0.0 108.126 -178.966 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.5 t -67.26 174.43 3.25 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 -179.436 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 13.1 m -49.23 -34.75 15.65 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -173.361 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -53.7 -44.06 69.47 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.73 0.271 . . . . 0.0 111.73 178.187 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.456 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.5 mp -88.48 -40.69 13.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.53 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.464 HD12 ' HB2' ' A' ' 551' ' ' SER . 0.0 OUTLIER -59.82 -38.04 80.89 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -175.644 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -66.99 -32.61 73.96 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.559 -179.002 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -90.23 -4.3 57.29 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.347 -0.221 . . . . 0.0 111.088 178.813 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -128.58 45.91 2.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.777 0.799 . . . . 0.0 112.484 -179.355 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 29.0 p -66.06 -26.91 67.71 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.426 -0.796 . . . . 0.0 112.399 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.4 -28.26 66.93 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.596 1.189 . . . . 0.0 112.465 178.383 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 91.4 t -68.69 -44.78 82.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 178.968 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.79 -37.5 79.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 178.354 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.42 -34.32 76.54 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.046 177.806 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.8 m -78.53 -39.47 37.85 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 118.48 0.582 . . . . 0.0 109.676 -179.801 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.55 HD23 HD11 ' A' ' 526' ' ' ILE . 44.0 mt -57.7 -34.92 69.96 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.962 0.41 . . . . 0.0 111.407 178.591 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -63.73 -29.13 70.39 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.879 -0.513 . . . . 0.0 111.629 175.232 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -74.02 -42.59 60.1 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 122.098 -0.376 . . . . 0.0 111.977 -179.741 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.55 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.83 -21.64 12.88 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -178.406 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 527' ' ' ARG . . . . . 0.417 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -65.02 -11.21 36.52 Favored 'General case' 0 C--O 1.214 -0.78 0 O-C-N 121.97 -0.456 . . . . 0.0 112.097 175.554 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 41.0 ptt85 -122.13 19.44 10.74 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 122.998 0.519 . . . . 0.0 111.596 175.334 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -65.48 120.46 12.9 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -175.606 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -85.98 -27.92 24.56 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -177.434 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.86 -41.45 95.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.245 0.545 . . . . 0.0 111.616 -175.289 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -132.35 112.5 12.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.948 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -62.62 -33.57 75.28 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.272 -179.314 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -58.17 -41.98 85.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.521 0.676 . . . . 0.0 111.34 -179.969 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 94.3 t -60.27 -41.02 85.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 O-C-N 121.876 -0.515 . . . . 0.0 109.618 178.238 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 38.1 ttm -57.8 -47.38 82.73 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 120.814 0.34 . . . . 0.0 110.122 179.073 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.24 -48.38 73.51 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.035 -179.458 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -72.03 -37.81 69.68 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 118.627 -1.229 . . . . 0.0 111.147 -175.399 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.94 -38.66 83.06 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.01 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 540' ' ' ALA . . . . . 0.417 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -66.83 -48.97 67.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.861 -1.063 . . . . 0.0 113.709 179.425 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -41.83 88.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -179.705 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 63.3 t -70.6 -51.03 40.52 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.593 -178.689 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -55.08 -44.74 75.11 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.597 0.237 . . . . 0.0 110.486 -177.554 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 20.7 m -67.07 -35.55 80.08 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 123.019 0.528 . . . . 0.0 110.727 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 16.0 mtt85 -60.58 -29.3 69.1 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 121.807 -0.558 . . . . 0.0 110.157 175.606 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.947 HD22 HG21 ' A' ' 508' ' ' VAL . 9.4 mt -76.2 -34.44 59.28 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 -175.603 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -31.5 70.85 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.061 178.205 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.6 m -79.6 -13.61 59.4 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 176.908 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -101.97 -31.11 10.83 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -179.398 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . 173.87 152.38 8.91 Favored Glycine 0 CA--C 1.519 0.316 0 N-CA-C 114.667 0.627 . . . . 0.0 114.667 179.476 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 551' ' ' SER . . . . . 0.464 ' HB2' HD12 ' A' ' 513' ' ' LEU . 2.2 m . . . . . 0 C--O 1.246 0.917 0 N-CA-C 115.999 1.851 . . . . 0.0 115.999 178.832 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -70.46 158.51 35.92 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 176.517 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 60.6 m -146.3 143.48 19.19 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.727 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.29 149.64 57.59 Favored 'Trans proline' 0 C--O 1.239 0.551 0 N-CA-C 113.966 0.718 . . . . 0.0 113.966 -179.099 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.5 m -71.35 165.61 23.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.274 179.191 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 49.9 t -54.38 -45.19 69.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.064 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 179.652 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 472' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -64.74 -34.13 77.59 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.796 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -68.0 -41.29 82.47 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 178.604 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -72.35 -32.61 66.63 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.219 -177.84 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 475' ' ' LEU . . . . . 0.421 HD23 HD21 ' A' ' 503' ' ' LEU . 1.6 tm? -56.61 -38.85 72.63 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.186 178.846 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -53.42 -40.45 65.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 118.345 0.52 . . . . 0.0 110.654 -179.065 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 56.8 tttt -67.36 -56.68 8.7 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 176.856 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -45.91 89.89 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -176.119 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -60.37 -43.32 96.67 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -179.739 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 67.4 m -62.17 -40.47 96.13 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.644 -178.574 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 481' ' ' GLU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.7 mm-40 -63.01 -38.72 92.33 Favored 'General case' 0 CA--C 1.508 -0.662 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.402 178.61 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -60.23 -43.57 93.64 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 179.472 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.41 -41.95 93.06 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.524 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -65.73 -34.33 77.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.801 0.334 . . . . 0.0 110.875 179.623 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.35 -17.13 64.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 179.398 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 486' ' ' LEU . . . . . 0.427 HD11 ' CG2' ' A' ' 526' ' ' ILE . 25.8 mt -108.59 12.14 26.17 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -178.614 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 6.0 mtpt -54.88 130.97 43.25 Favored 'General case' 0 C--O 1.209 -1.068 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 177.729 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.0 t -63.75 -41.17 91.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 122.468 1.127 . . . . 0.0 108.129 177.507 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -28.95 68.23 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 113.465 -1.698 . . . . 0.0 113.632 -179.337 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.3 t -159.75 76.08 2.99 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.799 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -75.56 144.5 28.53 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 116.6 -1.8 . . . . 0.0 113.535 179.407 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -137.08 104.27 5.38 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.277 0.561 . . . . 0.0 111.099 179.477 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.04 -46.09 94.69 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.934 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -57.02 -32.67 66.39 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 120.96 0.41 . . . . 0.0 109.931 -177.998 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -70.12 -40.29 74.94 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -176.234 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 496' ' ' CYS . . . . . 0.429 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.95 -49.04 71.91 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 176.007 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 74.9 mt -57.31 -44.1 83.85 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -175.998 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.62 -40.15 96.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.76 0.791 . . . . 0.0 110.336 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 499' ' ' ALA . . . . . 0.418 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -68.91 -46.92 67.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.361 0.6 . . . . 0.0 110.49 179.39 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 500' ' ' LEU . . . . . 0.429 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -55.88 -48.64 75.22 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.477 179.139 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -63.02 -35.62 80.83 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -175.483 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -69.98 -43.27 71.81 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 176.707 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 503' ' ' LEU . . . . . 0.421 HD21 HD23 ' A' ' 475' ' ' LEU . 1.5 tm? -59.29 -34.74 72.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.343 0.592 . . . . 0.0 110.336 -179.338 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.17 -17.98 62.09 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-O 119.207 -0.774 . . . . 0.0 114.745 179.78 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.3 t -112.95 -7.7 13.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.149 0.975 . . . . 0.0 111.064 -179.449 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.5 mt -72.72 148.57 44.55 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.523 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 507' ' ' GLN . . . . . 0.454 ' O ' HD13 ' A' ' 512' ' ' ILE . 34.4 tt0 -78.57 84.58 4.68 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 122.807 1.289 . . . . 0.0 109.985 178.388 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 508' ' ' VAL . . . . . 0.926 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -97.07 46.83 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.325 0 CA-C-O 122.748 1.261 . . . . 0.0 108.939 -178.181 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.0 t -67.28 172.43 4.81 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -178.244 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 15.7 m -49.36 -32.15 10.78 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -173.949 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.36 -45.3 76.52 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 122.348 -0.22 . . . . 0.0 111.528 177.799 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 512' ' ' ILE . . . . . 0.454 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.5 mp -86.86 -42.39 15.43 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.818 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 513' ' ' LEU . . . . . 0.444 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.08 -40.13 80.3 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -175.715 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -69.55 -29.43 67.01 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.354 -177.654 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -90.53 -3.34 57.67 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 122.338 -0.227 . . . . 0.0 110.979 177.537 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -128.76 45.3 2.81 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.71 0.767 . . . . 0.0 112.388 179.382 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 22.3 p -64.66 -27.35 68.86 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.881 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.39 -24.59 65.7 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 122.1 0.952 . . . . 0.0 112.207 178.167 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.5 t -71.74 -45.98 63.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 178.363 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.82 -35.54 71.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.846 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -58.21 -46.1 86.46 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 176.46 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.7 m -71.2 -39.15 71.97 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.641 -175.331 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 523' ' ' LEU . . . . . 0.668 HD23 HD11 ' A' ' 526' ' ' ILE . 72.7 mt -57.61 -35.47 70.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.884 0.373 . . . . 0.0 111.186 179.044 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -66.06 -29.12 69.41 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 121.789 -0.569 . . . . 0.0 112.382 176.912 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.92 -53.11 10.84 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.826 0.822 . . . . 0.0 110.419 179.633 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 526' ' ' ILE . . . . . 0.668 HD11 HD23 ' A' ' 523' ' ' LEU . 22.6 pt -65.47 -24.64 35.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -179.419 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.28 -16.92 61.79 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 176.004 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.73 19.2 13.24 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.791 0.437 . . . . 0.0 111.111 177.072 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -65.72 120.86 13.75 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 123.201 0.6 . . . . 0.0 111.462 -179.027 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -91.5 -19.42 22.82 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -178.126 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -69.49 -22.81 63.58 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.129 -177.754 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.68 128.98 12.0 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.749 174.774 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -64.28 -49.5 71.59 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.222 -178.454 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -58.17 -38.36 76.49 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.251 0.548 . . . . 0.0 111.808 -173.839 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.95 -44.9 79.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 176.873 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.6 ttp -68.32 -43.26 77.97 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 119.256 -0.402 . . . . 0.0 110.362 179.431 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -64.36 -47.78 78.03 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.406 -0.518 . . . . 0.0 112.354 -179.411 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -69.82 -38.09 76.46 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.42 -178.3 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.2 -40.73 86.7 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-O 121.619 0.723 . . . . 0.0 109.287 178.133 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.61 73.87 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.524 -1.217 . . . . 0.0 112.638 -179.923 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -42.48 90.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.454 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.2 t -70.5 -51.11 40.34 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.994 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.414 -178.317 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -54.49 -45.09 73.15 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -177.781 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.9 m -66.19 -35.11 79.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.297 0.57 . . . . 0.0 111.262 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 23.1 mtt85 -61.65 -30.07 70.48 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.783 -0.573 . . . . 0.0 109.947 174.933 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 546' ' ' LEU . . . . . 0.926 HD22 HG21 ' A' ' 508' ' ' VAL . 8.5 mt -76.68 -34.05 58.22 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -175.754 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -28.14 68.85 Favored 'General case' 0 C--O 1.217 -0.639 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.67 178.212 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.9 m -78.27 -8.52 58.47 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.92 -1.037 . . . . 0.0 111.991 177.769 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 64.1 mtt85 -116.87 -19.19 9.96 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -179.696 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -170.82 157.93 29.24 Favored Glycine 0 CA--C 1.518 0.281 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.971 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 12.9 m . . . . . 0 C--O 1.242 0.662 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.686 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.2 m . . . . . 0 C--O 1.226 -0.177 0 CA-C-O 121.091 0.472 . . . . 0.0 111.615 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.414 HG13 ' HB3' ' A' ' 506' ' ' LEU . 53.7 t -56.18 -47.78 80.24 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.907 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.751 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -63.44 -34.18 77.18 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -67.16 -42.74 83.83 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 177.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 17.5 mttt -69.43 -35.48 75.72 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 121.727 0.775 . . . . 0.0 109.997 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.437 HD21 HG21 ' A' ' 519' ' ' VAL . 1.5 tm? -57.13 -37.42 71.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.879 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -54.46 -40.68 68.63 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.405 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -72.36 -54.06 10.52 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.131 177.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.47 -46.75 73.43 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 -177.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.4 t-160 -61.33 -41.06 96.39 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 52.5 m -64.06 -40.57 96.56 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.97 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 72.3 mm-40 -63.72 -43.09 97.59 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-N 118.153 0.433 . . . . 0.0 110.652 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.02 -46.89 66.02 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.19 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 177.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -67.01 -39.5 87.11 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -177.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -68.57 -28.07 66.63 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 122.157 -0.339 . . . . 0.0 110.755 177.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.69 -18.42 62.82 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.6 mt -105.99 12.08 30.89 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.874 -177.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 52.4 mttt -54.09 127.29 26.03 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.6 t -62.26 -42.11 94.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.932 0.872 . . . . 0.0 109.678 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.33 -30.66 69.68 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.205 -1.362 . . . . 0.0 112.943 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 14.2 t -155.31 75.9 5.17 Favored Pre-proline 0 C--O 1.244 0.769 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -175.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -74.95 146.65 33.13 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 117.394 -1.271 . . . . 0.0 112.72 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -137.28 100.76 4.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.331 0.586 . . . . 0.0 109.762 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.72 -46.13 96.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -58.09 -31.12 66.81 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.064 0.227 . . . . 0.0 110.447 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -69.28 -41.11 77.28 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.441 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.69 -49.04 69.99 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.498 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 83.4 mt -56.85 -44.18 81.91 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.07 -41.07 97.77 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.6 0.714 . . . . 0.0 110.824 179.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.445 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.93 -47.3 69.07 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.286 0.565 . . . . 0.0 109.767 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.441 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.29 -46.32 79.82 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.186 177.641 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -64.66 -35.36 80.79 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 119.032 0.833 . . . . 0.0 113.123 -176.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -68.88 -46.61 67.95 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 176.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.427 HD21 HD23 ' A' ' 475' ' ' LEU . 0.9 OUTLIER -57.69 -33.23 68.15 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.427 0.632 . . . . 0.0 110.547 -179.417 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.76 -19.21 67.09 Favored Glycine 0 C--O 1.238 0.345 0 CA-C-O 119.312 -0.716 . . . . 0.0 114.543 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.7 t -109.98 -13.75 14.36 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.91 0.855 . . . . 0.0 110.237 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.414 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.0 mt -67.3 145.91 54.65 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.964 -0.46 . . . . 0.0 110.344 179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.426 ' O ' HD13 ' A' ' 512' ' ' ILE . 28.7 tt0 -79.37 84.45 5.28 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-O 122.79 1.281 . . . . 0.0 109.809 178.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.916 HG21 HD22 ' A' ' 546' ' ' LEU . 27.8 m -95.69 46.49 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 CA-C-O 122.9 1.333 . . . . 0.0 108.433 -179.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.4 t -66.67 171.78 4.84 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 -177.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.1 m -49.26 -30.9 7.89 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -174.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -56.09 -46.58 78.99 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 175.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.426 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -86.72 -41.77 15.08 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.438 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -57.51 -39.69 77.05 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.84 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -68.12 -31.21 70.64 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.392 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -90.38 -4.44 57.06 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 122.172 -0.33 . . . . 0.0 111.331 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . 0.409 ' HA ' HD22 ' A' ' 516' ' ' ASN . 7.2 m120 -127.94 41.11 3.56 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.276 0.56 . . . . 0.0 111.458 -179.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.2 p -63.64 -27.93 69.56 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 121.604 -0.685 . . . . 0.0 112.776 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.13 -26.41 68.18 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.617 0.722 . . . . 0.0 111.842 177.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.437 HG21 HD21 ' A' ' 475' ' ' LEU . 47.6 t -71.93 -43.15 68.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 44.9 t -62.71 -35.23 69.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 178.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.09 85.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 119.228 -0.415 . . . . 0.0 111.368 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.0 m -78.14 -37.91 44.96 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 118.991 0.814 . . . . 0.0 109.719 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.568 HD23 HD11 ' A' ' 526' ' ' ILE . 39.5 mt -57.97 -35.0 70.56 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.076 0.465 . . . . 0.0 111.178 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -64.56 -29.08 70.11 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.803 -0.561 . . . . 0.0 111.536 175.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -74.31 -41.62 60.83 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.568 HD11 HD23 ' A' ' 523' ' ' LEU . 1.2 pt -78.74 -23.14 13.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.103 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -13.07 32.64 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 176.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.7 ptt180 -119.14 16.35 13.23 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 122.822 0.449 . . . . 0.0 110.841 176.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -64.66 121.82 15.38 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.059 0.457 . . . . 0.0 112.103 -175.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -92.29 -25.62 18.5 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -177.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.02 -25.51 65.43 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.637 -177.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.86 121.22 9.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.915 0.388 . . . . 0.0 110.371 174.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -39.99 94.98 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.91 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -60.68 -40.95 94.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.614 0.721 . . . . 0.0 111.745 -176.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 59.4 t -56.01 -43.39 75.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.957 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.7 ttp -66.27 -40.73 90.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 122.066 0.146 . . . . 0.0 110.621 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.42 -48.41 70.12 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -69.7 -38.26 76.9 Favored 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 118.977 -1.089 . . . . 0.0 110.244 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.63 -39.87 81.75 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.2 -48.37 68.09 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -40.79 90.53 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 62.1 t -70.63 -53.1 23.73 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.3 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . 0.529 ' CE1' ' HD3' ' A' ' 547' ' ' LYS . 51.6 t80 -55.0 -41.74 71.65 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.181 0.515 . . . . 0.0 110.901 -177.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . 0.466 ' HA ' ' HE3' ' A' ' 547' ' ' LYS . 30.0 m -65.27 -38.55 90.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.141 0.496 . . . . 0.0 111.197 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 -64.74 -27.05 68.64 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.177 177.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.916 HD22 HG21 ' A' ' 508' ' ' VAL . 11.9 mt -73.94 -37.8 64.45 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -176.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . 0.529 ' HD3' ' CE1' ' A' ' 543' ' ' TYR . 5.2 mtmp? -63.76 -24.73 67.88 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.273 178.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.8 m . . . . . 0 C--N 1.319 -0.722 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.127 178.484 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.1 m . . . . . 0 C--O 1.221 -0.406 0 N-CA-C 111.745 0.276 . . . . 0.0 111.745 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.422 HG13 ' HB3' ' A' ' 506' ' ' LEU . 48.6 t -53.75 -49.25 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.429 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.8 pt-20 -65.92 -32.28 73.69 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.693 -178.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -67.47 -40.71 85.31 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 12.7 mtpt -72.32 -32.99 67.03 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.499 -176.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.7 -40.11 71.93 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.548 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -53.23 -39.85 64.11 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 121.245 -0.182 . . . . 0.0 110.895 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -71.97 -55.24 7.79 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.265 176.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -47.06 78.43 Favored 'General case' 0 C--O 1.218 -0.563 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -175.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -61.47 -39.88 92.49 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 59.1 m -64.92 -41.25 95.72 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.587 179.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.456 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.9 mm-40 -63.19 -43.17 98.94 Favored 'General case' 0 CA--C 1.506 -0.718 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.805 178.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.14 -47.62 66.76 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -67.36 -37.68 83.58 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -176.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -67.73 -31.64 71.71 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.55 -19.09 65.24 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 23.8 mt -103.06 12.19 36.27 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 38.6 mttt -55.57 128.52 34.93 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 72.2 t -61.43 -43.12 96.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.816 0.817 . . . . 0.0 109.66 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -74.23 -19.84 60.38 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.469 -1.242 . . . . 0.0 113.456 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 7.3 m -156.39 69.0 4.79 Favored Pre-proline 0 N--CA 1.47 0.574 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -176.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.58 145.11 29.16 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 114.267 -3.355 . . . . 0.0 112.573 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -137.33 96.76 3.33 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.892 0.853 . . . . 0.0 109.867 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.409 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.6 OUTLIER -56.32 -46.43 81.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -178.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.35 -30.67 69.69 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -69.73 -40.43 76.22 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 -178.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.456 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.97 -49.1 71.61 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.814 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 87.5 mt -56.64 -43.06 79.89 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -64.39 -38.54 91.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.387 0.613 . . . . 0.0 111.425 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.456 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.03 -48.53 68.07 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 177.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.456 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -56.38 -43.73 79.5 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.207 178.55 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -65.59 -33.78 76.7 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 119.315 0.961 . . . . 0.0 112.912 -177.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.98 -46.58 64.89 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 175.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -34.36 65.98 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.44 0.638 . . . . 0.0 110.983 -179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.92 -18.43 68.65 Favored Glycine 0 C--O 1.237 0.333 0 CA-C-O 119.235 -0.759 . . . . 0.0 114.883 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 15.1 t -110.29 -14.64 14.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 117.992 0.896 . . . . 0.0 110.354 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.422 ' HB3' HG13 ' A' ' 471' ' ' VAL . 3.5 mt -65.39 144.01 57.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.0 0.428 . . . . 0.0 110.728 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.464 ' O ' HD13 ' A' ' 512' ' ' ILE . 34.4 tt0 -78.62 84.34 4.73 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 122.46 1.124 . . . . 0.0 109.192 177.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.861 HG21 HD22 ' A' ' 546' ' ' LEU . 29.5 m -97.13 46.77 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-O 123.11 1.433 . . . . 0.0 108.922 -178.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.6 t -67.34 172.93 4.34 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.3 m -49.11 -33.68 12.34 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -173.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -55.18 -43.06 73.98 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 178.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.464 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.1 mp -88.45 -41.76 14.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.445 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.54 -39.16 83.04 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.404 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -67.13 -32.46 73.6 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.682 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -88.99 -3.85 58.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.999 -0.28 . . . . 0.0 110.56 178.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -129.01 42.73 3.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.4 p -64.28 -28.16 69.53 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.499 -0.751 . . . . 0.0 112.248 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -67.51 -24.05 65.53 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.506 0.67 . . . . 0.0 111.952 177.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 60.8 t -71.97 -45.13 65.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 178.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 42.7 t -62.24 -35.51 69.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.77 94.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.175 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 98.6 m -74.41 -38.99 62.94 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 119.168 0.895 . . . . 0.0 110.407 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.676 HD23 HD11 ' A' ' 526' ' ' ILE . 63.5 mt -57.29 -35.15 69.44 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.998 0.428 . . . . 0.0 111.334 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -65.7 -29.23 69.74 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.769 -0.582 . . . . 0.0 111.762 175.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -73.02 -44.42 60.9 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.974 0.416 . . . . 0.0 110.877 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.676 HD11 HD23 ' A' ' 523' ' ' LEU . 17.3 pt -78.54 -21.94 13.16 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.784 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -176.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.45 -18.36 58.58 Favored 'General case' 0 C--O 1.214 -0.803 0 O-C-N 121.741 -0.6 . . . . 0.0 111.968 175.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.75 19.42 13.16 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 122.897 0.479 . . . . 0.0 111.379 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -64.64 113.67 3.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.97 0.414 . . . . 0.0 112.01 -177.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -75.22 -30.0 60.44 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -176.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.25 95.77 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -174.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -131.21 110.83 11.42 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.11 -0.329 . . . . 0.0 110.11 -178.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 39.3 tptt -56.27 -43.85 79.19 Favored 'General case' 0 C--O 1.207 -1.139 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.211 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -55.49 -42.67 74.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.123 0.487 . . . . 0.0 112.172 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.1 t -57.09 -44.46 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -63.87 -44.24 93.68 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.59 -47.47 78.54 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 41.5 tptt -70.27 -38.95 75.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 118.488 -1.285 . . . . 0.0 110.715 -178.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.06 -40.94 86.72 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.368 0.604 . . . . 0.0 109.392 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -62.9 -48.73 77.7 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.081 -0.963 . . . . 0.0 113.503 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -41.76 89.68 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.2 t -70.51 -52.81 26.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.876 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.514 -177.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . 0.531 ' CE1' ' HD3' ' A' ' 547' ' ' LYS . 37.5 t80 -54.91 -42.51 72.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.343 0.592 . . . . 0.0 111.253 -177.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.5 m -66.95 -36.9 83.26 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.877 0.37 . . . . 0.0 110.447 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 10.7 mtt85 -63.69 -30.06 71.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.761 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.861 HD22 HG21 ' A' ' 508' ' ' VAL . 13.2 mt -71.7 -38.23 70.59 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -175.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . 0.531 ' HD3' ' CE1' ' A' ' 543' ' ' TYR . 4.2 mtmp? -61.08 -29.5 69.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.935 -1.029 . . . . 0.0 112.317 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 23.6 m . . . . . 0 C--N 1.32 -0.685 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.582 176.807 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--O 1.224 -0.252 0 CA-C-O 120.709 0.29 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.408 HG13 ' HB3' ' A' ' 506' ' ' LEU . 34.1 t -55.17 -46.85 77.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.019 0 O-C-N 122.114 -0.366 . . . . 0.0 110.719 178.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.26 -34.15 74.69 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -67.03 -40.93 87.31 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 122.378 1.085 . . . . 0.0 108.678 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -74.08 -34.8 64.13 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.35 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.567 HD21 HG21 ' A' ' 519' ' ' VAL . 4.2 tt -58.88 -36.82 75.28 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.244 177.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -57.58 -41.58 81.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 119.244 0.929 . . . . 0.0 109.908 178.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -68.07 -53.18 27.44 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.618 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -46.34 84.96 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -179.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.45 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.8 t-160 -58.41 -44.71 89.13 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.0 m -63.17 -38.59 91.77 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.57 -37.57 88.01 Favored 'General case' 0 CA--C 1.498 -1.03 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.75 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.7 mt -58.95 -42.26 85.51 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.053 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 22.4 mmtt -64.9 -45.36 86.27 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 120.864 0.364 . . . . 0.0 111.7 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -66.9 -28.51 68.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.414 -178.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.96 -17.81 63.32 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 122.722 0.409 . . . . 0.0 111.912 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.8 mt -109.63 12.14 24.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.605 -176.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -53.25 128.29 27.54 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.3 t -60.31 -42.36 90.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.825 0.822 . . . . 0.0 109.672 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -71.88 -24.87 61.74 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.378 -1.283 . . . . 0.0 113.168 -177.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 46.5 m -156.34 72.7 5.0 Favored Pre-proline 0 C--O 1.244 0.814 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -176.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.93 144.66 43.55 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 115.95 -2.234 . . . . 0.0 112.484 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -137.23 102.04 4.71 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.114 0.483 . . . . 0.0 109.874 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -61.08 -47.33 94.05 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.882 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -178.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -57.26 -31.16 65.29 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 123.118 0.261 . . . . 0.0 110.497 -178.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -69.38 -40.88 77.14 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.403 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.26 -49.56 69.12 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.479 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 70.2 mt -56.89 -44.13 82.01 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -176.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -61.45 -39.14 89.75 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.681 0.753 . . . . 0.0 111.749 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -72.18 -46.58 55.77 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.372 0.606 . . . . 0.0 109.831 178.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.403 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.62 -48.67 71.92 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.925 178.335 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -60.84 -35.99 77.97 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -175.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.13 -47.08 53.73 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.03 -34.48 68.23 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.335 0.588 . . . . 0.0 110.153 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.51 -14.53 64.78 Favored Glycine 0 C--O 1.236 0.224 0 N-CA-C 115.339 0.896 . . . . 0.0 115.339 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 15.1 t -111.97 -16.92 13.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 117.767 0.783 . . . . 0.0 110.493 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.408 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.6 mt -63.88 150.8 44.13 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.213 -0.304 . . . . 0.0 110.947 -178.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.464 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.2 tt0 -79.51 84.53 5.37 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-O 122.6 1.19 . . . . 0.0 109.188 178.136 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.896 HG21 HD22 ' A' ' 546' ' ' LEU . 30.0 m -101.04 48.21 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.279 0 CA-C-O 123.367 1.556 . . . . 0.0 108.029 -178.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 13.7 t -67.79 171.86 6.03 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.1 m -49.23 -31.0 7.89 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -173.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -55.45 -44.1 76.06 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 122.292 -0.255 . . . . 0.0 111.558 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.464 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.6 -42.36 14.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.543 0 CA-C-O 121.683 0.754 . . . . 0.0 109.275 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.466 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.11 -40.86 82.26 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -174.273 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -72.48 -28.74 63.09 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.399 -175.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -88.6 -9.16 53.16 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 122.198 -0.314 . . . . 0.0 110.762 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -125.53 39.71 3.9 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.486 0.66 . . . . 0.0 111.402 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -62.78 -23.87 67.44 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.67 -31.46 72.69 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.995 0.902 . . . . 0.0 112.365 178.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.567 HG21 HD21 ' A' ' 475' ' ' LEU . 60.2 t -70.26 -41.76 78.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 42.0 t -63.39 -37.71 80.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.2 -34.11 77.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.593 177.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 88.0 m -76.59 -39.39 52.72 Favored 'General case' 0 C--O 1.219 -0.509 0 O-C-N 122.172 -0.33 . . . . 0.0 110.414 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.664 HD23 HD11 ' A' ' 526' ' ' ILE . 57.9 mt -59.16 -35.0 72.76 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.215 0.531 . . . . 0.0 110.734 178.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -63.47 -29.14 70.47 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 122.007 -0.433 . . . . 0.0 111.159 175.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -73.82 -42.72 60.49 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.664 HD11 HD23 ' A' ' 523' ' ' LEU . 1.5 pt -78.77 -23.06 12.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -178.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.37 -13.96 34.9 Favored 'General case' 0 C--O 1.214 -0.791 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 177.039 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -118.59 15.83 13.69 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.094 0.558 . . . . 0.0 111.401 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -69.46 116.93 10.44 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 122.889 0.476 . . . . 0.0 111.409 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -92.35 -16.44 26.0 Favored 'General case' 0 C--O 1.217 -0.605 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -177.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -69.5 -22.23 63.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.472 -178.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -150.38 126.27 10.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.584 0.231 . . . . 0.0 110.654 174.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -63.06 -49.29 75.13 Favored 'General case' 0 C--O 1.21 -0.979 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.049 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -57.14 -39.31 74.94 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.259 0.552 . . . . 0.0 111.94 -174.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.88 -45.35 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 122.057 -0.402 . . . . 0.0 110.024 176.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.2 ttp -67.29 -44.0 80.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 119.407 -0.33 . . . . 0.0 110.2 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -64.04 -47.4 80.35 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -70.3 -37.99 74.88 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 119.245 -0.982 . . . . 0.0 110.954 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.56 -40.93 84.42 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-O 121.83 0.824 . . . . 0.0 108.813 178.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.427 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.78 -51.11 66.31 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.144 -1.389 . . . . 0.0 113.921 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -43.75 84.83 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.93 -52.16 37.24 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.93 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.449 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -54.56 -46.04 73.59 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.583 0.23 . . . . 0.0 110.534 -177.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 41.3 m -64.67 -36.56 84.67 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.639 0.776 . . . . 0.0 111.443 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -63.73 -27.84 69.48 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.649 -0.657 . . . . 0.0 110.704 175.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.896 HD22 HG21 ' A' ' 508' ' ' VAL . 11.5 mt -74.47 -36.23 63.29 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -30.62 70.12 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.459 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--N 1.318 -0.79 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.888 178.296 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.4 m . . . . . 0 CA--C 1.52 -0.174 0 CA-C-O 121.132 0.491 . . . . 0.0 111.805 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 46.9 t -55.93 -47.01 80.51 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.974 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.42 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.2 pt-20 -66.63 -34.17 77.27 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -179.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -66.16 -40.27 90.41 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -71.46 -34.69 70.45 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.64 0.733 . . . . 0.0 110.342 -179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -57.12 -39.78 75.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.437 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -53.63 -38.52 64.15 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.938 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -72.96 -54.22 9.2 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.012 175.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.81 -48.07 76.04 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -61.85 -40.73 96.37 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 66.8 m -63.86 -41.07 97.87 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.612 179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.73 -41.92 95.59 Favored 'General case' 0 CA--C 1.5 -0.961 0 C-N-CA 120.858 -0.337 . . . . 0.0 111.017 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.73 -46.14 73.81 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.273 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -67.78 -39.52 84.08 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -68.48 -30.55 69.42 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 120.717 0.294 . . . . 0.0 110.621 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.17 -18.84 65.45 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.6 mt -105.35 12.09 32.03 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -54.82 130.56 41.43 Favored 'General case' 0 C--O 1.21 -1.006 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.1 t -63.93 -41.19 91.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-O 122.152 0.977 . . . . 0.0 109.063 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -68.64 -28.49 66.94 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.919 -1.492 . . . . 0.0 113.24 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 66.3 m -158.93 76.2 3.28 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.66 146.64 49.38 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 115.702 -2.399 . . . . 0.0 111.794 178.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -137.31 91.32 2.6 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.749 0.785 . . . . 0.0 110.14 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.4 HG12 ' H ' ' A' ' 493' ' ' VAL . 1.3 p -57.21 -46.97 84.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 -177.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -58.87 -30.97 68.13 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -177.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -70.2 -41.91 73.06 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.444 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.02 -49.46 72.3 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 176.56 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.7 mt -57.3 -42.61 82.11 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -176.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -65.17 -39.18 92.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.369 0.604 . . . . 0.0 111.407 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.62 -47.65 69.03 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.444 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.21 -44.78 79.83 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.389 177.638 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -66.8 -34.31 77.55 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 119.264 0.938 . . . . 0.0 113.493 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -69.1 -45.11 71.05 Favored 'General case' 0 C--O 1.225 -0.216 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 176.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.59 -33.37 66.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.543 0.687 . . . . 0.0 110.069 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.25 -16.17 64.34 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-O 119.181 -0.788 . . . . 0.0 114.656 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.7 t -114.82 -12.44 12.1 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.311 1.056 . . . . 0.0 110.815 179.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.1 mt -67.47 144.92 55.46 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.752 -0.593 . . . . 0.0 111.179 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.422 ' O ' HD13 ' A' ' 512' ' ' ILE . 2.2 mt-30 -76.44 84.35 3.17 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-O 122.684 1.231 . . . . 0.0 109.279 177.07 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.914 HG21 HD22 ' A' ' 546' ' ' LEU . 29.1 m -97.99 46.91 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 CA-C-O 122.596 1.189 . . . . 0.0 109.127 -178.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.7 t -67.41 172.84 4.5 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 46.1 m -49.32 -33.92 14.42 Favored 'General case' 0 C--O 1.218 -0.596 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -174.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -53.33 -44.86 68.78 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.422 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.35 -42.6 14.93 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.435 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.28 -39.17 78.54 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -175.196 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -70.26 -29.71 66.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.114 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -90.16 -2.45 58.07 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.345 -0.222 . . . . 0.0 110.95 177.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -129.61 45.48 2.8 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.759 0.79 . . . . 0.0 111.999 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.4 p -64.84 -28.53 69.62 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.731 -0.606 . . . . 0.0 112.515 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -67.04 -26.27 66.68 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.508 0.671 . . . . 0.0 111.885 178.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.84 -43.42 79.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 41.6 t -63.85 -35.43 73.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.63 -38.21 89.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 119.305 -0.378 . . . . 0.0 110.963 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.6 m -75.43 -39.24 59.13 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 118.999 0.818 . . . . 0.0 109.654 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.525 HD23 HD11 ' A' ' 526' ' ' ILE . 46.8 mt -57.57 -35.0 69.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.03 0.443 . . . . 0.0 111.394 178.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -64.66 -29.16 70.15 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.878 -0.514 . . . . 0.0 111.561 175.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -73.4 -49.02 29.27 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.622 0.248 . . . . 0.0 110.984 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.525 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -73.34 -21.9 19.01 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.963 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 -175.326 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -60.45 -18.35 50.72 Favored 'General case' 0 C--O 1.214 -0.785 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 176.639 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -118.81 19.37 13.14 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 122.911 0.484 . . . . 0.0 111.279 176.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -63.19 113.6 3.27 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 121.156 0.503 . . . . 0.0 111.842 -176.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -75.54 -30.97 59.91 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 115.686 1.736 . . . . 0.0 115.686 -176.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.65 -42.43 95.44 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.032 0.444 . . . . 0.0 112.159 -174.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -129.88 109.81 11.2 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.4 tptt -56.06 -42.47 76.7 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.938 178.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -55.7 -43.08 76.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.154 0.502 . . . . 0.0 111.795 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 69.2 t -57.99 -43.74 85.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 177.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -44.63 95.8 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.78 -47.74 77.02 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.605 -0.438 . . . . 0.0 112.013 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -68.59 -39.94 80.72 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.854 -178.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.42 -41.11 88.76 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.442 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.26 -48.33 78.63 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -42.15 95.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.253 0.549 . . . . 0.0 109.681 -179.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 77.3 t -70.57 -51.63 35.68 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.456 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -53.44 -45.26 69.4 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 122.526 0.33 . . . . 0.0 110.841 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 22.6 m -65.03 -36.91 85.9 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 122.925 0.49 . . . . 0.0 111.342 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 42.2 mtt85 -62.0 -28.95 69.93 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 121.672 -0.643 . . . . 0.0 110.661 176.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.914 HD22 HG21 ' A' ' 508' ' ' VAL . 5.5 mt -76.51 -31.72 57.84 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 -176.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 -31.64 72.48 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.81 177.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 16.2 m . . . . . 0 C--N 1.319 -0.746 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 177.017 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.7 m . . . . . 0 C--O 1.224 -0.287 0 CA-C-O 120.862 0.363 . . . . 0.0 110.891 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.4 t -54.25 -45.91 67.88 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -65.03 -34.07 77.55 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -66.44 -41.36 89.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -73.21 -33.3 65.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.808 -176.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.476 HD21 HG21 ' A' ' 519' ' ' VAL . 5.1 tt -59.69 -35.49 74.6 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.631 178.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -58.12 -40.27 80.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 119.037 0.835 . . . . 0.0 110.053 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -65.32 -55.83 16.09 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -45.8 90.37 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -177.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.445 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.9 t-160 -58.61 -42.72 88.82 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 53.9 m -64.63 -39.08 93.07 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 121.197 -0.201 . . . . 0.0 111.434 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.415 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.3 mm-40 -63.54 -37.67 88.18 Favored 'General case' 0 CA--C 1.508 -0.653 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.6 178.589 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.6 mt -59.17 -43.02 88.55 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -63.45 -44.92 93.11 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.75 -32.4 73.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.79 0.329 . . . . 0.0 110.979 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.58 -17.34 64.6 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.3 mt -109.69 12.06 24.33 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -55.29 132.4 47.81 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 177.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.73 -41.45 92.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 122.316 1.055 . . . . 0.0 108.723 177.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -66.42 -31.22 71.85 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 113.519 -1.673 . . . . 0.0 113.152 -178.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 11.1 t -160.48 76.97 2.65 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -175.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -73.99 144.95 34.94 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 116.68 -1.747 . . . . 0.0 112.716 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -137.34 102.24 4.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.685 0.755 . . . . 0.0 110.88 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.446 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.5 OUTLIER -60.11 -45.39 95.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -179.098 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -59.66 -31.9 69.97 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -70.1 -41.13 74.43 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -177.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -48.75 73.1 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 176.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 87.5 mt -56.94 -44.59 82.66 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -176.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -63.16 -39.04 93.51 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.799 0.809 . . . . 0.0 111.446 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.71 -47.27 63.74 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.448 0.642 . . . . 0.0 109.934 178.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.59 -48.26 75.13 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.641 178.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.36 -36.6 82.73 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -175.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -70.05 -45.7 66.55 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -35.77 70.42 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.295 0.569 . . . . 0.0 110.054 -179.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.91 -17.65 67.75 Favored Glycine 0 C--O 1.244 0.762 0 N-CA-C 115.288 0.875 . . . . 0.0 115.288 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.9 t -108.56 -13.43 14.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.512 0.656 . . . . 0.0 109.822 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.1 mt -69.99 149.47 47.7 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.466 ' O ' HD13 ' A' ' 512' ' ' ILE . 35.4 tt0 -79.82 84.39 5.62 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-O 122.56 1.172 . . . . 0.0 109.281 177.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.941 HG21 HD22 ' A' ' 546' ' ' LEU . 27.3 m -98.16 47.93 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 CA-C-O 123.247 1.499 . . . . 0.0 107.608 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.9 t -66.31 173.68 3.09 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 113.807 -1.542 . . . . 0.0 107.167 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.3 m -49.38 -34.67 16.69 Favored 'General case' 0 C--O 1.215 -0.713 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -54.28 -45.15 72.43 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 177.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -86.52 -40.0 13.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 CA-C-O 121.691 0.758 . . . . 0.0 109.324 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.4 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.79 -38.16 81.13 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -175.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -67.1 -35.0 78.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.348 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -86.83 -6.86 58.67 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.116 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -128.74 45.64 2.75 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.914 0.864 . . . . 0.0 112.924 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.9 p -65.0 -24.23 67.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.357 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.08 -33.84 76.68 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.56 1.172 . . . . 0.0 112.231 178.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.476 HG21 HD21 ' A' ' 475' ' ' LEU . 86.1 t -68.43 -43.45 84.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.3 t -63.43 -37.1 78.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.36 -36.68 84.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.582 177.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.6 m -75.58 -39.73 57.64 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 118.215 0.461 . . . . 0.0 109.797 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.59 HD23 HD11 ' A' ' 526' ' ' ILE . 55.4 mt -58.19 -34.88 70.84 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.921 0.391 . . . . 0.0 111.257 178.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -64.22 -29.07 70.19 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.858 -0.526 . . . . 0.0 111.317 175.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -73.76 -46.02 48.27 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.72 0.295 . . . . 0.0 111.401 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.59 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -77.49 -20.6 14.07 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.164 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -176.956 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.466 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.21 -15.6 47.74 Favored 'General case' 0 C--O 1.211 -0.957 0 O-C-N 121.952 -0.467 . . . . 0.0 112.156 176.056 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -119.21 19.33 12.88 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.155 0.582 . . . . 0.0 111.456 176.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -63.75 116.25 5.55 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.276 0.56 . . . . 0.0 112.294 -175.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -83.18 -27.99 29.65 Favored 'General case' 0 C--O 1.216 -0.667 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -177.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.26 -27.38 66.28 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -147.97 114.94 6.12 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 177.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -63.12 -38.27 90.5 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -175.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -58.77 -38.94 79.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.919 0.39 . . . . 0.0 111.481 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.6 t -58.47 -44.64 89.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 177.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 3.3 ttp -64.22 -42.03 96.76 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 110.445 -0.206 . . . . 0.0 110.445 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.3 -49.43 74.04 Favored 'General case' 0 C--N 1.32 -0.713 0 O-C-N 123.191 0.307 . . . . 0.0 111.164 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.6 tptt -71.33 -38.05 71.7 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 118.868 -1.133 . . . . 0.0 111.335 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.7 -40.91 85.02 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.466 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.7 -51.12 66.42 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.748 -1.115 . . . . 0.0 113.904 178.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -44.03 90.16 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 -179.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.7 t -67.4 -51.23 54.56 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.957 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.811 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -54.26 -44.67 72.0 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -178.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 28.1 m -65.28 -39.21 92.26 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.132 0.573 . . . . 0.0 111.3 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 43.1 mtt-85 -57.95 -31.74 67.13 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 121.844 -0.535 . . . . 0.0 110.109 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.941 HD22 HG21 ' A' ' 508' ' ' VAL . 4.1 mt -76.62 -31.79 57.63 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -175.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 -38.89 91.25 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.772 177.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 18.1 m . . . . . 0 C--N 1.322 -0.628 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 178.169 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 5.5 m . . . . . 0 C--O 1.219 -0.507 0 CA-C-O 120.781 0.324 . . . . 0.0 111.181 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -53.35 -45.54 56.68 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.956 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -33.62 75.98 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -178.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -70.59 -40.37 73.27 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -74.1 -31.66 62.9 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.708 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.34 -39.24 66.89 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.239 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -53.21 -38.74 63.14 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.4 0.148 . . . . 0.0 111.4 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -67.89 -58.22 4.93 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.332 176.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -46.48 88.87 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -174.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.2 t-160 -59.29 -41.15 88.27 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 59.5 m -65.64 -39.32 91.29 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 118.184 0.447 . . . . 0.0 111.46 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.476 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 10.9 mm-40 -63.28 -38.03 89.55 Favored 'General case' 0 CA--C 1.506 -0.721 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.92 178.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.63 -43.13 86.74 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.121 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 179.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 53.9 mmtt -63.18 -45.6 91.04 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.04 -33.1 75.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.885 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.78 -18.48 65.39 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 30.9 mt -108.45 12.02 26.51 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 -177.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 47.3 mttt -55.18 129.18 37.25 Favored 'General case' 0 C--O 1.21 -0.985 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 176.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 53.8 t -62.92 -41.81 94.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-O 122.261 1.029 . . . . 0.0 108.638 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -68.51 -26.77 65.62 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.592 -1.64 . . . . 0.0 113.573 -179.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 26.8 m -158.12 73.04 4.02 Favored Pre-proline 0 N--CA 1.473 0.722 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.21 145.14 34.31 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 115.728 -2.381 . . . . 0.0 112.79 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -137.23 97.78 3.57 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.714 0.769 . . . . 0.0 110.553 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.436 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.7 OUTLIER -57.39 -46.57 85.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -179.412 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -58.42 -32.1 68.35 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -71.19 -40.64 71.09 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 -176.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.459 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -64.3 -49.43 71.83 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 175.792 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.6 mt -56.84 -43.28 80.94 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -176.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -65.54 -38.07 88.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.471 0.653 . . . . 0.0 111.795 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.476 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -66.04 -48.52 70.81 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.818 0.818 . . . . 0.0 109.33 177.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.459 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.23 -43.43 82.87 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.059 178.581 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -60.6 -37.47 81.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 119.035 0.834 . . . . 0.0 112.476 -177.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.02 -41.45 59.3 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.518 -0.873 . . . . 0.0 108.84 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.7 -34.01 69.0 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.422 0.629 . . . . 0.0 110.108 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.38 -19.31 66.42 Favored Glycine 0 N--CA 1.452 -0.29 0 N-CA-C 114.915 0.726 . . . . 0.0 114.915 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.7 t -112.41 -13.81 13.35 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.102 0.951 . . . . 0.0 110.925 -178.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.72 144.66 56.76 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.441 ' O ' HD13 ' A' ' 512' ' ' ILE . 29.5 tt0 -77.84 84.78 4.14 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-O 122.814 1.293 . . . . 0.0 109.561 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.919 HG21 HD22 ' A' ' 546' ' ' LEU . 27.6 m -97.22 48.11 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-O 122.862 1.315 . . . . 0.0 108.281 -178.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.6 t -66.62 172.75 3.9 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 22.5 m -49.22 -33.28 12.21 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -174.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -55.44 -44.32 76.22 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.323 -0.236 . . . . 0.0 111.442 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.441 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -86.13 -42.06 15.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.455 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.41 -37.28 80.35 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -174.909 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -67.82 -31.75 71.82 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.524 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -89.73 -4.71 57.57 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 121.016 -0.273 . . . . 0.0 110.599 178.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -128.48 46.32 2.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.596 0.712 . . . . 0.0 112.24 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 25.7 p -65.59 -25.6 67.47 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 121.455 -0.778 . . . . 0.0 112.257 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.71 -29.08 68.24 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 122.682 1.229 . . . . 0.0 112.405 178.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 79.5 t -68.62 -44.74 82.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.4 t -63.86 -37.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.93 -35.35 79.82 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.867 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 92.3 m -77.46 -38.85 48.44 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 118.749 0.704 . . . . 0.0 109.41 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.554 HD23 HD11 ' A' ' 526' ' ' ILE . 43.8 mt -58.21 -35.21 71.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.06 0.457 . . . . 0.0 111.117 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -64.5 -29.11 70.15 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.923 -0.486 . . . . 0.0 111.486 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -74.29 -42.12 60.07 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.006 0.372 . . . . 0.0 112.006 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.554 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.84 -22.7 12.88 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.002 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 -178.047 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -16.87 55.99 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 176.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -118.74 19.34 13.19 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 123.323 0.649 . . . . 0.0 111.336 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -67.5 110.75 3.78 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -73.82 -30.34 62.65 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -176.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.1 -41.85 97.12 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -174.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -131.53 109.29 10.16 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -178.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -54.99 -43.34 73.46 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.97 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -55.03 -42.76 73.0 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.995 0.426 . . . . 0.0 111.999 -177.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 74.7 t -58.14 -44.46 87.57 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -62.53 -44.61 95.92 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.07 -47.16 78.25 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.38 -0.528 . . . . 0.0 112.185 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.0 tptt -68.67 -39.43 80.63 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.295 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.5 -40.23 86.39 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 121.59 0.709 . . . . 0.0 109.113 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -64.49 -48.95 73.26 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.703 -1.135 . . . . 0.0 113.113 179.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -42.74 90.74 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.7 t -69.45 -52.01 36.71 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.912 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.276 -178.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -54.0 -46.07 71.65 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 122.291 0.236 . . . . 0.0 110.661 -176.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 17.3 m -65.97 -35.28 80.15 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 122.884 0.474 . . . . 0.0 111.026 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -61.74 -29.69 70.28 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.775 -0.578 . . . . 0.0 110.154 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.919 HD22 HG21 ' A' ' 508' ' ' VAL . 8.6 mt -76.52 -32.13 58.09 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 -175.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.05 -28.89 69.92 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.601 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 23.0 m . . . . . 0 C--N 1.315 -0.916 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.336 176.691 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.0 m . . . . . 0 C--O 1.224 -0.242 0 CA-C-O 120.924 0.393 . . . . 0.0 111.5 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.418 HG13 ' HB3' ' A' ' 506' ' ' LEU . 40.1 t -54.16 -47.92 66.53 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 O-C-N 122.027 -0.421 . . . . 0.0 111.702 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.411 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.1 pt-20 -61.69 -34.18 75.3 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -178.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.13 -42.24 80.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 122.237 1.018 . . . . 0.0 108.46 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -71.65 -35.32 70.33 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.469 -177.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.452 HD21 HG21 ' A' ' 519' ' ' VAL . 4.6 tt -58.15 -35.38 71.45 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.72 178.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -56.7 -42.15 78.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 118.966 0.803 . . . . 0.0 109.778 177.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -68.37 -53.8 21.51 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.727 178.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -46.15 83.69 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 112.284 0.475 . . . . 0.0 112.284 -178.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.46 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.3 t-160 -58.09 -44.72 87.76 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.7 m -63.14 -38.22 90.31 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.437 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.3 mm-40 -64.66 -37.43 87.54 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.43 178.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.1 mt -58.92 -43.42 88.56 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.7 mmtt -63.66 -42.14 98.12 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -66.95 -34.69 78.32 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 120.788 0.327 . . . . 0.0 110.583 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -16.12 63.94 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 36.4 mt -111.94 12.08 20.72 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -58.56 133.24 55.66 Favored 'General case' 0 CA--C 1.489 -1.379 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 15.7 m -69.23 -16.13 20.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.022 177.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -91.89 -23.53 19.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.949 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 50.6 m -161.15 73.55 2.62 Favored Pre-proline 0 N--CA 1.469 0.494 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -175.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.35 142.55 33.65 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 113.822 -3.652 . . . . 0.0 112.381 178.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -137.36 101.86 4.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.589 0.709 . . . . 0.0 110.532 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.452 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.4 OUTLIER -57.54 -45.4 86.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.015 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 13.2 pttt -59.53 -32.32 70.2 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-O 121.718 0.77 . . . . 0.0 109.605 -176.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -71.53 -39.63 70.6 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.064 -176.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.425 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -66.71 -49.15 66.97 Favored 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 91.4 mt -56.9 -43.3 81.21 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 111.519 0.192 . . . . 0.0 111.519 -176.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -65.89 -33.23 75.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.418 0.628 . . . . 0.0 112.204 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.437 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -72.62 -47.06 50.9 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.425 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.53 -45.87 80.9 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.439 179.434 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -60.46 -36.32 77.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 119.063 0.847 . . . . 0.0 112.688 -176.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.36 -47.32 43.23 Favored 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.76 -35.01 68.14 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.183 0.516 . . . . 0.0 110.768 -178.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.75 -18.05 69.88 Favored Glycine 0 C--O 1.241 0.592 0 N-CA-C 115.156 0.822 . . . . 0.0 115.156 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.0 t -108.63 -14.16 14.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 117.554 0.677 . . . . 0.0 110.059 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.418 ' HB3' HG13 ' A' ' 471' ' ' VAL . 3.4 mt -67.82 148.49 51.13 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.417 ' O ' HD13 ' A' ' 512' ' ' ILE . 32.1 tt0 -79.09 84.25 5.1 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-O 122.734 1.254 . . . . 0.0 108.785 177.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.959 HG21 HD22 ' A' ' 546' ' ' LEU . 30.3 m -98.92 49.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.353 0 CA-C-O 123.133 1.444 . . . . 0.0 107.527 -178.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.4 t -67.1 173.15 3.94 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 34.4 m -49.32 -32.37 10.99 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -174.055 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.53 -44.46 76.72 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 177.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.417 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -88.05 -42.52 15.01 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 CA-C-O 121.62 0.724 . . . . 0.0 109.264 -179.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.477 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.48 -40.08 81.76 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -175.396 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -70.21 -31.05 68.32 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.191 -177.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -88.65 -7.85 55.64 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.397 178.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -126.29 40.85 3.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.564 0.697 . . . . 0.0 111.745 -178.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 11.6 p -62.66 -24.02 67.41 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 -179.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.4 -31.09 72.15 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.557 0.694 . . . . 0.0 112.102 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.46 HG22 ' CG ' ' A' ' 479' ' ' HIS . 24.3 t -70.92 -41.99 77.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 38.3 t -62.91 -38.46 81.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.48 -32.59 74.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.613 177.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.4 m -79.68 -39.38 31.46 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.479 HD23 HD11 ' A' ' 526' ' ' ILE . 37.1 mt -58.27 -35.65 72.1 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.199 0.523 . . . . 0.0 111.069 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -63.52 -29.09 70.41 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 122.117 -0.365 . . . . 0.0 111.412 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -74.07 -44.3 54.61 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 122.318 -0.239 . . . . 0.0 111.637 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.479 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -78.81 -19.96 13.02 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -176.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.86 -13.44 44.95 Favored 'General case' 0 C--O 1.212 -0.896 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 176.542 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -120.88 19.38 11.74 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 122.999 0.52 . . . . 0.0 111.505 176.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -64.98 118.82 9.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.111 0.482 . . . . 0.0 112.183 -177.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -83.79 -29.7 27.18 Favored 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -177.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.12 99.39 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.32 0.581 . . . . 0.0 111.488 -174.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.9 m120 -132.9 111.61 11.2 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -60.32 -36.53 78.13 Favored 'General case' 0 C--O 1.21 -0.993 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.793 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -57.1 -42.3 80.52 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.241 0.543 . . . . 0.0 112.138 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.4 t -58.5 -43.08 86.13 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 5.3 ttp -64.8 -40.82 95.86 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -63.87 -51.55 64.06 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -70.34 -38.79 74.91 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 119.289 -0.964 . . . . 0.0 111.751 -177.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.79 -39.4 80.96 Favored 'General case' 0 C--O 1.212 -0.878 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.421 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.71 -48.77 70.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.518 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -42.25 91.87 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.1 t -70.4 -50.29 47.08 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.452 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -55.93 -44.97 78.84 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.643 0.258 . . . . 0.0 110.36 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 19.1 m -67.63 -33.64 75.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.339 0.59 . . . . 0.0 110.954 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 10.9 mtt85 -61.44 -28.52 69.33 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 121.78 -0.575 . . . . 0.0 109.932 175.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.959 HD22 HG21 ' A' ' 508' ' ' VAL . 11.0 mt -76.68 -35.22 58.06 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 -175.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -27.74 69.35 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.395 177.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 C--N 1.316 -0.885 0 CA-C-N 114.693 -1.14 . . . . 0.0 111.739 177.886 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.7 m . . . . . 0 C--O 1.223 -0.311 0 CA-C-O 120.924 0.392 . . . . 0.0 111.335 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.416 HG13 ' HB3' ' A' ' 506' ' ' LEU . 25.7 t -53.18 -48.63 54.12 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -34.09 77.16 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -66.17 -39.57 89.85 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -74.33 -35.87 63.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.03 -178.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.496 HD21 HG21 ' A' ' 519' ' ' VAL . 5.3 tt -59.03 -35.51 73.43 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.531 177.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -56.38 -41.03 75.57 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -69.64 -53.22 19.76 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.43 -46.35 83.65 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -59.39 -41.82 90.26 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.6 m -64.66 -41.16 96.28 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.289 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.472 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 16.3 mm-40 -62.79 -41.94 99.49 Favored 'General case' 0 CA--C 1.503 -0.841 0 CA-C-N 117.964 0.347 . . . . 0.0 110.648 178.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.93 -46.9 76.48 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.206 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -67.47 -37.52 83.04 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -67.41 -32.61 73.62 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.77 0.319 . . . . 0.0 110.265 177.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.34 -17.8 64.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 179.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 31.6 mt -105.84 12.06 31.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 2.9 mttt -54.81 129.01 35.56 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 176.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.27 -40.46 89.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 CA-C-O 122.809 1.29 . . . . 0.0 107.852 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -65.12 -28.48 69.46 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.81 -1.996 . . . . 0.0 113.441 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 69.5 m -162.26 75.45 2.17 Favored Pre-proline 0 N--CA 1.474 0.73 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -73.5 143.75 35.01 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 114.741 -3.039 . . . . 0.0 112.605 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -137.21 100.91 4.39 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.398 0.618 . . . . 0.0 110.09 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -59.5 -46.72 92.64 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.891 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -57.11 -32.06 65.92 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -69.9 -40.43 75.63 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 119.868 -0.733 . . . . 0.0 109.162 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.421 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.01 -48.33 74.3 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.033 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.1 mt -56.96 -44.38 82.55 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 117.944 0.338 . . . . 0.0 111.855 -176.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.2 t30 -61.6 -38.92 89.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.797 0.808 . . . . 0.0 111.541 179.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.72 -48.55 59.11 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.5 0.667 . . . . 0.0 109.791 178.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.421 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.44 -48.51 71.62 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.162 178.708 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.99 -35.82 79.65 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -175.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -46.73 61.68 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 176.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.04 -34.27 68.05 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.368 0.604 . . . . 0.0 110.247 -178.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.17 -17.47 68.08 Favored Glycine 0 C--O 1.241 0.533 0 N-CA-C 115.101 0.801 . . . . 0.0 115.101 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.8 t -110.99 -12.06 14.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 117.867 0.834 . . . . 0.0 110.081 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.416 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.1 mt -69.63 147.48 50.61 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 121.917 -0.489 . . . . 0.0 110.057 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.414 ' O ' HD13 ' A' ' 512' ' ' ILE . 36.1 tt0 -78.73 84.48 4.81 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-O 122.83 1.3 . . . . 0.0 108.965 177.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.892 HG21 HD22 ' A' ' 546' ' ' LEU . 28.4 m -99.05 46.32 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 -179.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.1 t -66.16 169.69 6.73 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 -177.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 22.9 m -49.29 -29.4 5.88 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 114.266 1.209 . . . . 0.0 114.266 -174.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -55.62 -47.53 76.42 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.309 -0.244 . . . . 0.0 111.322 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.414 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -86.03 -39.84 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 CA-C-O 121.424 0.63 . . . . 0.0 109.513 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.442 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.92 -36.53 77.2 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -175.658 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -66.64 -32.94 74.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.786 0.803 . . . . 0.0 111.384 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -92.5 -1.13 57.18 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.997 -1.002 . . . . 0.0 111.753 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -132.29 43.25 3.03 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.663 0.744 . . . . 0.0 112.457 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 21.2 p -64.44 -25.57 68.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.14 -32.2 73.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.725 0.774 . . . . 0.0 112.354 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.496 HG21 HD21 ' A' ' 475' ' ' LEU . 61.5 t -68.39 -41.34 83.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.6 t -63.39 -37.01 78.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 178.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.72 -38.22 89.63 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.535 177.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 99.2 m -74.85 -38.11 62.06 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 118.5 0.591 . . . . 0.0 110.455 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.689 HD23 HD11 ' A' ' 526' ' ' ILE . 65.1 mt -58.82 -34.15 71.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.98 0.419 . . . . 0.0 111.034 178.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -65.08 -29.19 70.05 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.755 -0.59 . . . . 0.0 111.26 175.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -73.14 -42.73 62.54 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 122.239 -0.288 . . . . 0.0 111.441 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.689 HD11 HD23 ' A' ' 523' ' ' LEU . 2.2 pt -78.87 -24.13 13.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.04 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.423 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.59 -14.09 38.72 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 121.736 -0.602 . . . . 0.0 112.187 176.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -118.72 18.69 13.35 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.357 0.663 . . . . 0.0 111.516 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -68.74 106.26 2.59 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -175.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -75.97 -23.23 55.33 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.54 -24.4 64.63 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -177.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -151.67 126.18 9.47 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.511 -0.475 . . . . 0.0 112.062 174.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 46.4 tptt -62.21 -50.13 73.0 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.408 -178.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -57.82 -39.82 78.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.251 0.548 . . . . 0.0 111.455 -174.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 54.8 t -56.1 -45.36 80.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 176.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.8 ttp -67.41 -43.41 81.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.542 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -64.24 -47.64 78.89 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.0 tptt -69.48 -37.94 77.47 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.669 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . 0.419 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -58.82 -41.57 87.17 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.27 -51.09 67.57 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.599 -1.182 . . . . 0.0 113.322 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -44.71 90.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 -179.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.5 t -67.75 -50.0 64.45 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.998 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.179 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -54.58 -44.58 73.12 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.6 m -65.46 -39.04 91.54 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 122.925 0.49 . . . . 0.0 111.317 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 35.8 mtt-85 -57.74 -31.74 66.76 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 121.874 -0.516 . . . . 0.0 110.447 175.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.892 HD22 HG21 ' A' ' 508' ' ' VAL . 3.3 mt -76.69 -31.7 57.4 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -37.83 88.62 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.45 178.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--N 1.319 -0.721 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.502 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 C--O 1.22 -0.455 0 CA-C-O 120.822 0.344 . . . . 0.0 111.419 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.411 HG13 ' HB3' ' A' ' 506' ' ' LEU . 51.8 t -54.31 -47.55 68.82 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.947 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.433 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.7 pt-20 -63.38 -33.9 76.56 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 122.525 0.33 . . . . 0.0 111.781 -178.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -68.36 -41.56 80.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 178.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -72.74 -32.72 65.89 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.842 -176.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.445 HD23 HD21 ' A' ' 503' ' ' LEU . 1.2 tm? -56.35 -35.61 67.85 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.698 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -54.7 -39.95 68.68 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.952 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 39.1 tttt -66.46 -54.3 25.68 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 176.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -47.36 85.66 Favored 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -176.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -61.01 -40.57 94.06 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 66.1 m -64.04 -41.93 97.24 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.424 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -63.91 -42.69 97.35 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-O 119.426 -0.321 . . . . 0.0 111.349 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.43 -46.44 70.48 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.272 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -68.09 -38.42 82.33 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -176.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -68.37 -31.19 70.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.709 0.29 . . . . 0.0 110.245 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -19.17 65.71 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.5 mt -105.84 12.15 31.1 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -55.62 129.41 38.96 Favored 'General case' 0 C--O 1.209 -1.038 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 177.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.7 t -63.15 -40.64 89.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 122.363 1.078 . . . . 0.0 108.504 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -68.43 -27.14 65.92 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 113.491 -1.686 . . . . 0.0 113.148 -178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 49.4 m -159.43 74.0 3.29 Favored Pre-proline 0 N--CA 1.47 0.563 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -176.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.45 145.93 43.59 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 114.701 -3.066 . . . . 0.0 112.372 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -137.3 91.74 2.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.523 0.678 . . . . 0.0 110.154 -176.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.414 HG12 ' H ' ' A' ' 493' ' ' VAL . 1.1 p -57.37 -46.02 85.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -177.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -58.06 -31.36 66.98 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 120.843 0.354 . . . . 0.0 110.089 -177.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -70.9 -42.08 70.42 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 -177.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.486 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -63.26 -49.44 74.09 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 176.602 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 80.8 mt -57.01 -42.89 81.2 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -176.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -66.01 -38.35 88.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.297 0.57 . . . . 0.0 111.468 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -65.77 -48.25 72.45 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.658 0.742 . . . . 0.0 109.22 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.486 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.76 -44.52 81.85 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.552 177.425 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -62.41 -36.97 84.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 119.161 0.891 . . . . 0.0 112.32 -177.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -71.77 -43.92 64.9 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.445 HD21 HD23 ' A' ' 475' ' ' LEU . 0.8 OUTLIER -60.8 -31.71 71.09 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.399 0.619 . . . . 0.0 110.246 -179.111 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.82 -17.41 62.84 Favored Glycine 0 C--O 1.24 0.517 0 CA-C-O 119.507 -0.607 . . . . 0.0 114.494 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 12.2 t -114.85 -13.36 11.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.742 0.771 . . . . 0.0 111.048 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.411 ' HB3' HG13 ' A' ' 471' ' ' VAL . 2.2 mt -67.0 146.41 54.39 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.439 ' O ' HD13 ' A' ' 512' ' ' ILE . 35.5 tt0 -77.67 84.22 4.02 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 122.515 1.15 . . . . 0.0 110.17 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.892 HG21 HD22 ' A' ' 546' ' ' LEU . 26.9 m -98.27 47.56 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 CA-C-O 122.942 1.353 . . . . 0.0 109.079 -178.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.2 t -66.94 173.61 3.53 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 20.1 m -49.38 -32.99 12.61 Favored 'General case' 0 C--O 1.214 -0.794 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -173.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -55.44 -43.9 75.8 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 177.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.439 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -87.14 -41.85 14.94 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 CA-C-O 121.518 0.675 . . . . 0.0 109.32 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.455 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.92 -38.08 81.32 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -174.64 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -67.62 -32.91 73.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.716 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -88.69 -7.38 56.42 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.671 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -123.49 40.58 3.69 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.122 0.487 . . . . 0.0 111.017 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 12.0 p -62.63 -29.53 70.69 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.638 -0.664 . . . . 0.0 112.766 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -63.17 -29.21 70.61 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.527 0.68 . . . . 0.0 111.633 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.402 HG21 HD21 ' A' ' 475' ' ' LEU . 46.9 t -71.45 -43.79 72.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 43.1 t -61.95 -39.99 85.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.02 76.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.293 177.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.8 m -77.57 -38.55 48.17 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 118.883 0.765 . . . . 0.0 109.939 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.704 HD23 HD11 ' A' ' 526' ' ' ILE . 55.1 mt -58.66 -34.32 71.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.148 0.499 . . . . 0.0 110.208 177.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 5.4 mtpp -61.73 -34.36 75.68 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.008 -0.432 . . . . 0.0 111.66 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -69.71 -45.51 68.08 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.728 0.299 . . . . 0.0 111.769 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.704 HD11 HD23 ' A' ' 523' ' ' LEU . 3.9 pt -78.42 -22.59 13.29 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -175.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.469 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -64.36 -12.28 40.82 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 121.903 -0.498 . . . . 0.0 112.168 175.367 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -121.38 18.95 11.39 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 122.604 0.361 . . . . 0.0 111.51 175.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -67.92 118.4 11.07 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -176.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -85.19 -26.15 26.94 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -177.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.63 -41.59 98.24 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.174 0.511 . . . . 0.0 111.367 -175.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -130.93 109.92 10.89 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.82 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -58.18 -39.31 78.61 Favored 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.801 178.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -56.54 -42.79 79.09 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.385 0.612 . . . . 0.0 111.262 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 69.0 t -59.89 -44.06 93.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 29.3 ttm -57.98 -48.01 81.28 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 122.61 0.364 . . . . 0.0 110.4 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.68 -47.15 76.42 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -72.12 -37.31 69.5 Favored 'General case' 0 CA--C 1.513 -0.468 0 C-N-CA 118.148 -1.421 . . . . 0.0 110.778 -176.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . 0.405 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -59.11 -40.87 86.68 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 178.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.4 -49.92 71.89 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.04 -43.8 91.69 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 -178.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 65.1 t -69.18 -50.06 56.14 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.971 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.493 -176.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -54.31 -44.82 72.34 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.11 -0.329 . . . . 0.0 110.11 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.4 m -66.38 -36.22 82.31 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.914 0.486 . . . . 0.0 111.291 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 41.1 mtt-85 -60.47 -28.92 68.71 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.735 -0.603 . . . . 0.0 110.329 175.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.892 HD22 HG21 ' A' ' 508' ' ' VAL . 7.8 mt -76.77 -33.42 58.07 Favored 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -175.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -29.64 70.31 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.755 178.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.8 m . . . . . 0 C--N 1.317 -0.828 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.173 176.913 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.9 m . . . . . 0 C--O 1.224 -0.238 0 CA-C-O 120.942 0.401 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.403 HG13 ' HB3' ' A' ' 506' ' ' LEU . 43.1 t -54.65 -48.02 72.15 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.14 0 O-C-N 122.042 -0.411 . . . . 0.0 111.824 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -60.25 -34.25 73.44 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -68.77 -42.89 76.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 122.166 0.984 . . . . 0.0 108.603 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -72.57 -34.84 67.75 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.332 -176.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.551 HD21 HG21 ' A' ' 519' ' ' VAL . 2.1 tt -57.0 -40.3 76.33 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.364 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -60.35 -37.18 79.87 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.59 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -68.72 -53.44 22.06 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.828 176.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -45.33 82.81 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 118.557 0.617 . . . . 0.0 112.191 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.426 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.4 t-160 -57.44 -43.78 84.18 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 48.7 m -64.63 -38.5 91.21 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.422 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 50.5 mm-40 -65.47 -35.8 81.97 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.046 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.4 -42.34 83.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.024 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -64.16 -45.25 89.29 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -65.13 -33.41 75.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.272 -178.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.83 -18.05 65.07 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 29.8 mt -108.56 12.08 26.26 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -177.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -54.49 129.69 36.94 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.8 t -62.94 -41.17 91.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 122.612 1.196 . . . . 0.0 107.819 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -65.63 -28.03 68.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.052 -1.886 . . . . 0.0 113.549 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 5.7 m -159.63 72.7 3.28 Favored Pre-proline 0 N--CA 1.473 0.691 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -176.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -73.4 143.01 34.18 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 114.281 -3.346 . . . . 0.0 112.509 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -137.22 100.44 4.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.581 0.705 . . . . 0.0 109.976 -178.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.7 -47.88 91.13 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.889 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -177.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -57.04 -32.05 65.78 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.9 ttt180 -68.84 -40.25 79.53 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 -177.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.4 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.85 -49.81 69.12 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 175.696 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 60.9 mt -56.54 -44.36 80.81 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -175.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -62.82 -39.95 95.87 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.716 0.769 . . . . 0.0 111.206 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.422 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -70.88 -45.68 63.97 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 121.745 -0.597 . . . . 0.0 110.0 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.4 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.58 -49.51 70.2 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.594 177.202 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -61.89 -36.06 80.16 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -175.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.38 -46.44 66.92 Favored 'General case' 0 C--O 1.223 -0.337 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.94 -33.64 67.2 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.498 0.666 . . . . 0.0 109.951 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.23 -17.53 68.27 Favored Glycine 0 N--CA 1.452 -0.288 0 N-CA-C 115.115 0.806 . . . . 0.0 115.115 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.2 t -111.87 -11.44 13.91 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.989 0.895 . . . . 0.0 110.241 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.403 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.2 mt -69.37 148.67 49.33 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 121.896 -0.503 . . . . 0.0 109.822 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.443 ' O ' HD13 ' A' ' 512' ' ' ILE . 35.7 tt0 -78.25 84.15 4.47 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-O 122.49 1.138 . . . . 0.0 108.864 177.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.926 HG21 HD22 ' A' ' 546' ' ' LEU . 27.2 m -98.55 47.22 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-O 123.21 1.481 . . . . 0.0 107.708 -178.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.3 t -66.8 171.93 4.82 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 -178.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.7 m -49.15 -33.69 12.65 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -173.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -55.62 -44.79 77.38 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 176.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 507' ' ' GLN . 3.9 mp -83.63 -42.48 17.48 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 CA-C-O 122.036 0.922 . . . . 0.0 108.611 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -37.7 76.56 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -176.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -67.11 -33.44 75.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.425 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -89.35 -9.74 49.27 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.248 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -125.08 41.7 3.45 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.516 0.674 . . . . 0.0 112.002 -175.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 22.8 p -62.24 -27.43 68.99 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -66.95 -26.54 66.88 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.551 HG21 HD21 ' A' ' 475' ' ' LEU . 43.0 t -71.71 -42.26 70.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.2 t -63.33 -37.35 79.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.57 -34.46 77.86 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.872 177.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.1 m -77.27 -39.84 46.72 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 118.072 0.396 . . . . 0.0 110.203 179.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 526' ' ' ILE . 54.1 mt -58.24 -35.37 71.61 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.082 0.467 . . . . 0.0 110.929 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -63.32 -29.01 70.4 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.062 -0.399 . . . . 0.0 111.348 175.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -74.58 -42.95 57.83 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.648 HD11 HD23 ' A' ' 523' ' ' LEU . 1.3 pt -78.78 -23.38 13.0 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.4 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -60.8 -17.13 47.63 Favored 'General case' 0 C--O 1.214 -0.784 0 O-C-N 121.994 -0.442 . . . . 0.0 111.955 176.406 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -118.68 19.13 13.3 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.01 0.524 . . . . 0.0 111.386 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -67.07 115.49 6.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.083 0.468 . . . . 0.0 111.992 -176.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -83.78 -21.99 32.0 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 -177.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -70.42 -22.45 62.72 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 120.527 -0.469 . . . . 0.0 112.119 -177.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -152.24 126.68 9.36 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.588 175.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.8 tptt -64.37 -47.8 77.9 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.555 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -57.75 -39.78 78.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.339 0.59 . . . . 0.0 111.347 -174.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 59.8 t -55.99 -45.15 80.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.121 176.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.2 ttp -65.87 -44.08 86.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.28 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.04 -46.69 80.2 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -69.43 -38.95 78.07 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.682 -0.807 . . . . 0.0 110.871 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.64 85.99 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.37 -50.98 65.56 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.439 -1.255 . . . . 0.0 113.361 179.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -42.13 89.53 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.55 -49.66 50.83 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.935 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.177 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -55.12 -44.82 75.37 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.5 m -66.4 -36.94 84.11 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 122.829 0.451 . . . . 0.0 110.997 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 5.7 mtt85 -58.32 -31.78 67.86 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.023 -0.423 . . . . 0.0 110.118 175.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.926 HD22 HG21 ' A' ' 508' ' ' VAL . 4.6 mt -76.64 -31.75 57.57 Favored 'General case' 0 CA--C 1.5 -0.958 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -176.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -38.86 92.59 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.153 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.2 m . . . . . 0 C--N 1.32 -0.699 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 178.137 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.9 m . . . . . 0 C--O 1.225 -0.187 0 CA-C-O 121.098 0.475 . . . . 0.0 111.645 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 41.1 t -55.87 -47.57 79.54 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.858 0 O-C-N 122.109 -0.37 . . . . 0.0 111.656 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.412 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.3 pt-20 -63.53 -33.95 76.71 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -67.73 -42.32 82.1 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -69.66 -33.25 72.32 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.63 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.16 -38.95 71.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.741 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -53.86 -39.53 65.73 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.855 -178.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -70.9 -55.43 8.46 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.34 -47.72 78.23 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -60.95 -40.31 92.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 64.6 m -64.85 -42.0 95.25 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.921 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -62.99 -41.79 99.66 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.03 178.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -54.41 -48.45 68.87 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.021 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -65.9 -40.51 91.6 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -176.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -68.88 -26.59 65.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.655 0.264 . . . . 0.0 111.004 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -72.5 -17.68 61.73 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 178.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . 0.421 HD11 ' CG2' ' A' ' 526' ' ' ILE . 25.0 mt -103.93 12.14 34.66 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -55.27 128.01 32.01 Favored 'General case' 0 C--O 1.21 -1.019 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 178.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 52.5 t -63.0 -40.46 89.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 122.117 0.96 . . . . 0.0 109.46 179.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -65.87 -31.64 72.69 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 113.981 -1.463 . . . . 0.0 112.691 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 17.2 t -159.8 78.19 2.76 Favored Pre-proline 0 C--O 1.246 0.877 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.799 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.29 148.73 44.18 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 115.832 -2.312 . . . . 0.0 112.153 178.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -137.32 97.72 3.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.61 0.719 . . . . 0.0 109.093 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.436 HG22 ' HB3' ' A' ' 532' ' ' ASN . 70.8 t -59.13 -42.85 87.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.676 -178.427 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -60.46 -35.64 76.35 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.492 0.587 . . . . 0.0 110.871 -177.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 40.7 ttm180 -65.1 -43.07 93.25 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.097 0.475 . . . . 0.0 109.933 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.467 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.3 OUTLIER -65.27 -50.39 65.94 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 177.584 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 86.7 mt -56.9 -42.29 79.63 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 111.357 0.132 . . . . 0.0 111.357 -176.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -65.62 -38.57 89.81 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.35 0.595 . . . . 0.0 111.67 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -66.57 -47.18 73.6 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 177.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.467 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -57.35 -42.71 82.55 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.605 177.685 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -64.77 -37.15 86.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 119.073 0.851 . . . . 0.0 112.541 -177.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -69.83 -45.01 68.76 Favored 'General case' 0 C--O 1.225 -0.219 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 177.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.76 -35.31 68.49 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.291 0.567 . . . . 0.0 110.927 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.94 -19.27 67.53 Favored Glycine 0 C--O 1.24 0.506 0 N-CA-C 114.928 0.731 . . . . 0.0 114.928 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.3 t -109.06 -16.28 14.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 117.582 0.691 . . . . 0.0 110.091 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.7 mt -65.03 144.16 57.47 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.348 0.594 . . . . 0.0 109.935 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.503 ' O ' HD13 ' A' ' 512' ' ' ILE . 47.4 mt-30 -78.12 84.52 4.35 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 122.01 0.91 . . . . 0.0 109.747 177.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.833 HG21 HD22 ' A' ' 546' ' ' LEU . 35.5 m -98.92 45.0 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-O 123.008 1.385 . . . . 0.0 108.03 179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.45 173.69 3.16 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.148 -1.387 . . . . 0.0 107.691 -177.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.28 -32.44 10.88 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 -173.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.49 -45.11 77.04 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.503 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.66 -39.23 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 0 CA-C-O 121.2 0.524 . . . . 0.0 109.718 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -35.82 75.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -175.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -64.74 -32.81 74.66 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.567 0.698 . . . . 0.0 111.71 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -95.05 1.16 55.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.592 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -132.2 42.97 3.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.845 0.831 . . . . 0.0 111.917 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.0 p -65.22 -28.65 69.51 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 121.673 -0.642 . . . . 0.0 111.905 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -67.38 -26.21 66.35 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.547 0.689 . . . . 0.0 111.991 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 65.5 t -70.24 -43.86 78.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 178.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 44.0 t -62.49 -35.3 69.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 178.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.43 -39.88 94.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 119.018 -0.515 . . . . 0.0 111.203 177.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 99.3 m -73.57 -39.15 64.87 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 119.33 0.968 . . . . 0.0 109.911 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.672 HD23 HD11 ' A' ' 526' ' ' ILE . 62.7 mt -57.87 -35.31 70.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.791 0.329 . . . . 0.0 111.09 178.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -65.35 -29.04 69.73 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.751 -0.593 . . . . 0.0 111.548 175.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -73.15 -44.63 59.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.021 0.438 . . . . 0.0 110.631 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.672 HD11 HD23 ' A' ' 523' ' ' LEU . 14.7 pt -78.26 -24.48 13.76 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.847 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -175.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.499 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -59.26 -19.37 45.4 Favored 'General case' 0 C--O 1.213 -0.833 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 176.039 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -118.67 19.12 13.31 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 122.911 0.484 . . . . 0.0 111.784 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.401 ' HB2' ' HA ' ' A' ' 526' ' ' ILE . 7.9 t80 -73.19 104.62 4.31 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.232 0.539 . . . . 0.0 111.624 -176.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -68.32 -32.33 72.37 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 116.419 2.007 . . . . 0.0 116.419 -175.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.68 -44.33 94.05 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 122.195 0.998 . . . . 0.0 112.007 -176.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . 0.436 ' HB3' HG22 ' A' ' 493' ' ' VAL . 67.1 m-20 -113.99 90.34 3.32 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 -174.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -53.22 -50.0 65.63 Favored 'General case' 0 C--O 1.207 -1.163 0 O-C-N 122.33 -0.231 . . . . 0.0 110.958 -179.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -58.9 -37.74 77.3 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.845 0.355 . . . . 0.0 111.625 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . 0.416 HG23 HG13 ' A' ' 493' ' ' VAL . 42.7 t -57.62 -44.41 85.3 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.559 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -63.93 -44.94 91.38 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.53 -47.67 80.69 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -70.44 -40.24 73.89 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 119.552 -0.859 . . . . 0.0 110.648 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.89 -40.02 87.32 Favored 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.499 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -61.01 -49.41 77.51 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 178.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -44.31 95.66 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.54 -51.45 51.54 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.774 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.059 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -53.93 -46.2 71.46 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 122.787 0.435 . . . . 0.0 110.27 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 33.2 m -63.29 -38.96 93.21 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 122.966 0.506 . . . . 0.0 110.982 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -62.21 -29.75 70.6 Favored 'General case' 0 C--O 1.215 -0.734 0 O-C-N 121.69 -0.631 . . . . 0.0 110.803 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.833 HD22 HG21 ' A' ' 508' ' ' VAL . 5.2 mt -75.12 -30.73 60.92 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 -178.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -34.37 77.94 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.712 177.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.0 m . . . . . 0 C--N 1.32 -0.674 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 177.357 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.9 m . . . . . 0 C--O 1.225 -0.231 0 CA-C-O 121.125 0.488 . . . . 0.0 112.189 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.445 HG13 ' HB3' ' A' ' 506' ' ' LEU . 38.0 t -54.17 -48.99 65.31 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.878 0 O-C-N 122.027 -0.421 . . . . 0.0 111.997 179.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.41 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.2 pt-20 -61.26 -34.2 74.78 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -178.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -67.47 -41.77 84.07 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -72.51 -35.47 68.12 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.942 -177.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.553 HD21 HG21 ' A' ' 519' ' ' VAL . 3.8 tt -58.29 -37.83 75.82 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.578 178.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -57.73 -41.87 82.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 118.593 0.633 . . . . 0.0 110.293 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -67.53 -53.17 30.79 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 120.378 -0.529 . . . . 0.0 110.089 178.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -44.7 86.47 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.434 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.9 t-160 -58.31 -43.85 88.35 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -179.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.9 m -63.77 -37.66 88.19 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -65.78 -37.66 86.91 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.193 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -58.08 -45.51 88.35 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.115 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 24.4 mmtt -61.11 -45.63 93.9 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -64.17 -34.51 78.23 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.715 0.293 . . . . 0.0 110.639 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.73 -16.54 64.18 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.9 mt -109.99 12.11 23.8 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -56.78 130.62 46.39 Favored 'General case' 0 C--O 1.21 -1.024 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 46.2 t -62.5 -40.93 89.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 122.303 1.049 . . . . 0.0 108.863 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -67.19 -30.19 70.07 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.638 -1.619 . . . . 0.0 113.093 -178.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.6 t -160.93 76.4 2.53 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -175.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -75.54 146.46 30.81 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 116.896 -1.603 . . . . 0.0 113.053 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -137.21 99.96 4.13 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.447 0.641 . . . . 0.0 110.354 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.3 -46.17 81.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -58.43 -32.68 68.92 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 121.935 0.874 . . . . 0.0 109.773 -176.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -70.76 -39.87 73.01 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.325 -1.307 . . . . 0.0 108.835 -175.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.409 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -66.01 -50.14 65.29 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 175.243 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 79.2 mt -56.62 -43.09 79.88 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -175.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.74 -38.38 90.81 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.619 0.723 . . . . 0.0 111.868 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -71.24 -45.24 63.69 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 121.655 -0.653 . . . . 0.0 109.617 178.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.409 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -55.04 -48.14 73.82 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.804 177.243 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -62.33 -35.64 79.71 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -175.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -67.41 -49.4 63.96 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.96 -33.51 62.42 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.393 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.95 -18.52 70.78 Favored Glycine 0 C--O 1.24 0.471 0 N-CA-C 115.176 0.831 . . . . 0.0 115.176 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.5 t -109.95 -13.36 14.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 118.085 0.942 . . . . 0.0 110.225 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.445 ' HB3' HG13 ' A' ' 471' ' ' VAL . 5.2 mt -67.02 146.85 53.92 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 122.021 -0.424 . . . . 0.0 110.949 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.469 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.4 tt0 -78.65 84.43 4.75 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-O 122.544 1.164 . . . . 0.0 109.103 177.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.913 HG21 HD22 ' A' ' 546' ' ' LEU . 27.0 m -98.82 47.39 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-O 122.968 1.366 . . . . 0.0 108.708 -178.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.8 t -66.78 172.34 4.42 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 106.824 -1.546 . . . . 0.0 106.824 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.0 m -49.17 -32.87 11.06 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -173.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -55.39 -44.81 76.49 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.469 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -85.75 -41.83 15.63 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.448 0 CA-C-O 121.774 0.797 . . . . 0.0 109.231 179.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.484 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.69 -37.51 79.04 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -175.387 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -65.39 -31.98 73.38 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.604 0.716 . . . . 0.0 112.203 -178.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -93.72 -6.12 46.89 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.085 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -127.93 39.97 3.76 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.533 0.682 . . . . 0.0 111.819 -178.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 28.2 p -63.8 -24.83 67.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -61.83 -32.54 72.87 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.475 0.655 . . . . 0.0 112.313 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.553 HG21 HD21 ' A' ' 475' ' ' LEU . 21.3 t -71.32 -40.99 74.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 31.7 t -62.86 -38.36 81.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.42 -30.2 71.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.948 177.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.6 m -82.58 -39.26 22.51 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.48 HD23 HD11 ' A' ' 526' ' ' ILE . 31.9 mt -57.56 -36.53 71.79 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.285 0.564 . . . . 0.0 110.881 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -62.44 -28.55 69.88 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 122.165 -0.335 . . . . 0.0 111.536 175.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -76.96 -42.18 40.12 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 178.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.48 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -78.76 -22.23 12.95 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.106 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -177.303 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.432 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -60.52 -18.12 50.02 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 122.431 0.292 . . . . 0.0 111.547 175.674 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -118.67 19.38 13.22 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.198 0.599 . . . . 0.0 111.571 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -66.64 110.35 3.18 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.195 0.521 . . . . 0.0 112.187 -176.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -74.39 -28.05 60.92 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.15 -41.67 94.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -175.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -131.94 111.05 11.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 -178.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -55.58 -44.24 76.73 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.045 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -55.9 -42.74 76.45 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.004 0.431 . . . . 0.0 112.058 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -57.56 -44.38 84.97 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -62.83 -44.49 96.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.063 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.25 -46.89 78.74 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.3 tptt -69.04 -39.66 79.07 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 119.1 -1.04 . . . . 0.0 111.071 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.72 -40.26 87.4 Favored 'General case' 0 C--O 1.212 -0.87 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.432 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.42 -50.44 71.49 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.287 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -45.5 89.72 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 60.6 t -67.11 -49.57 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.979 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.202 -177.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -56.01 -44.98 79.21 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 26.6 m -66.12 -35.63 81.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.295 0.569 . . . . 0.0 111.161 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 54.2 mtt-85 -61.27 -27.81 68.74 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 121.705 -0.622 . . . . 0.0 110.469 175.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.913 HD22 HG21 ' A' ' 508' ' ' VAL . 9.9 mt -76.48 -35.78 58.22 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -176.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -28.01 69.71 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 114.735 -1.121 . . . . 0.0 111.432 178.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 C--N 1.314 -0.961 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.662 178.137 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.8 m . . . . . 0 C--O 1.223 -0.325 0 CA-C-O 120.819 0.342 . . . . 0.0 111.557 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 39.3 t -53.76 -48.41 61.25 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.05 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -63.16 -34.21 77.13 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -178.34 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.69 -39.92 88.32 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 179.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -74.16 -35.79 64.05 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.214 -178.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.555 HD21 HG21 ' A' ' 519' ' ' VAL . 5.2 tt -58.63 -38.68 78.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.047 -0.978 . . . . 0.0 109.332 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -55.21 -40.32 70.66 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -71.8 -53.61 12.81 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.27 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -45.84 79.47 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -178.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.45 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.9 t-160 -59.13 -41.94 89.44 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -179.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.5 m -65.21 -40.02 93.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 119.441 -0.314 . . . . 0.0 111.196 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.5 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 50.5 mm-40 -65.02 -40.51 94.98 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.368 178.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.9 mt -54.29 -48.5 67.35 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.06 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -65.89 -38.36 88.55 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -177.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -66.84 -32.35 73.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.664 0.269 . . . . 0.0 110.299 177.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -20.42 66.0 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.9 mt -101.15 12.05 38.32 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 12.6 mtpp -56.72 122.22 11.62 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 40.1 t -60.98 -39.04 80.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 122.481 1.134 . . . . 0.0 109.4 178.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -64.26 -28.21 69.57 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 113.525 -1.67 . . . . 0.0 112.811 -178.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -168.73 81.13 0.74 Allowed Pre-proline 0 N--CA 1.47 0.538 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.13 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.87 149.44 33.28 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 118.083 -0.811 . . . . 0.0 113.182 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -137.28 99.23 3.92 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.526 0.679 . . . . 0.0 110.871 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.96 -45.36 87.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -179.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -58.79 -32.13 69.05 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -69.49 -40.28 77.12 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.431 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.99 -49.92 66.1 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 176.053 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.64 -43.97 80.83 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -176.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -63.5 -37.45 87.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.565 0.698 . . . . 0.0 111.447 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.5 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -70.48 -47.49 60.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.365 0.603 . . . . 0.0 109.601 178.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.431 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.65 -49.01 71.61 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.227 178.021 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -61.73 -35.37 77.87 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -175.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -47.86 57.89 Favored 'General case' 0 C--O 1.224 -0.266 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 176.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.7 -34.02 67.04 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.401 0.62 . . . . 0.0 110.197 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.94 -17.89 68.09 Favored Glycine 0 C--O 1.236 0.259 0 N-CA-C 115.292 0.877 . . . . 0.0 115.292 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.9 t -110.86 -11.31 14.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 118.003 0.901 . . . . 0.0 110.235 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.7 mt -68.85 148.87 49.62 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 121.939 -0.475 . . . . 0.0 110.296 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.445 ' O ' HD13 ' A' ' 512' ' ' ILE . 26.5 tt0 -77.28 84.48 3.72 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 122.719 1.247 . . . . 0.0 109.087 177.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.901 HG21 HD22 ' A' ' 546' ' ' LEU . 31.1 m -100.28 50.18 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 CA-C-O 122.969 1.366 . . . . 0.0 108.167 -178.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.1 t -66.53 171.87 4.64 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 40.4 m -49.32 -31.49 9.27 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -175.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -55.43 -45.08 76.8 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.445 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.1 mp -86.05 -42.88 16.19 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -37.98 81.82 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -175.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -69.23 -30.29 68.41 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.219 -178.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -89.16 -5.24 57.88 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 122.187 -0.321 . . . . 0.0 110.901 177.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -129.87 43.95 3.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.591 0.71 . . . . 0.0 112.426 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.8 p -63.66 -25.27 68.14 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.08 -31.61 72.91 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.001 0.905 . . . . 0.0 111.922 178.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.555 HG21 HD21 ' A' ' 475' ' ' LEU . 57.8 t -69.53 -42.84 80.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 26.5 t -62.72 -38.07 80.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.93 -39.05 93.41 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.334 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 92.6 m -73.68 -38.08 65.03 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 118.483 0.583 . . . . 0.0 110.464 -178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.66 HD23 HD11 ' A' ' 526' ' ' ILE . 63.1 mt -58.7 -35.75 73.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.136 0.493 . . . . 0.0 110.593 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -65.77 -29.14 69.6 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.878 -0.514 . . . . 0.0 111.357 175.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -72.22 -45.51 59.97 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.915 0.388 . . . . 0.0 110.808 178.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.66 HD11 HD23 ' A' ' 523' ' ' LEU . 16.6 pt -78.75 -20.61 12.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.806 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 -176.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.428 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.4 OUTLIER -62.45 -17.56 59.69 Favored 'General case' 0 C--O 1.213 -0.864 0 O-C-N 121.783 -0.573 . . . . 0.0 111.897 176.022 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.7 19.35 13.21 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.217 0.607 . . . . 0.0 111.411 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -65.5 114.65 5.03 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.024 0.44 . . . . 0.0 111.943 -177.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -75.2 -29.92 60.48 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.45 -40.72 96.26 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -132.57 112.1 11.79 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.23 -178.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 40.2 tptt -56.67 -43.69 80.64 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.388 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -55.74 -43.27 76.46 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.189 0.441 . . . . 0.0 112.189 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 67.4 t -57.35 -44.51 84.35 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -63.85 -43.53 95.85 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.99 -47.94 75.74 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.858 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -69.28 -38.98 78.6 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 118.864 -1.134 . . . . 0.0 110.586 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . 0.402 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -59.37 -41.26 88.88 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-O 121.442 0.639 . . . . 0.0 109.498 178.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.428 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.91 -48.25 77.34 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.913 -1.04 . . . . 0.0 112.924 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -41.51 92.58 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 52.8 t -70.6 -51.25 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.286 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -54.63 -45.9 73.83 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 122.499 0.32 . . . . 0.0 110.278 -177.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 16.0 m -65.78 -34.61 78.56 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.289 0.566 . . . . 0.0 111.197 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.01 -28.76 70.32 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 121.803 -0.561 . . . . 0.0 109.966 175.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.901 HD22 HG21 ' A' ' 508' ' ' VAL . 9.1 mt -76.57 -33.33 58.49 Favored 'General case' 0 C--O 1.207 -1.143 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 -176.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -27.28 69.15 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.208 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.5 m . . . . . 0 C--N 1.315 -0.915 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.866 177.751 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.7 m . . . . . 0 C--O 1.224 -0.269 0 CA-C-O 120.733 0.301 . . . . 0.0 111.184 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 51.7 t -55.86 -46.77 80.21 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 CA-C-O 120.879 0.371 . . . . 0.0 111.626 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.9 OUTLIER -65.92 -34.1 77.36 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.894 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -67.92 -40.86 83.33 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 176.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -69.14 -34.66 75.37 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.035 -178.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -56.09 -39.9 72.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.398 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -53.4 -39.7 64.51 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.995 -178.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -70.69 -56.49 6.29 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.619 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -45.8 86.04 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -176.118 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -59.49 -42.65 92.61 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 58.5 m -63.59 -38.45 91.17 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.075 0.234 . . . . 0.0 111.306 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.407 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 10.8 mm-40 -64.25 -38.25 90.39 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.649 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 92.5 mt -59.93 -41.73 87.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.088 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 51.6 mmtt -64.5 -45.22 88.2 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 121.832 -0.543 . . . . 0.0 112.068 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -65.77 -32.17 73.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.712 0.292 . . . . 0.0 110.794 -178.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.63 -16.97 64.58 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 178.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 34.5 mt -111.21 12.3 21.8 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -177.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -54.19 133.33 44.38 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 177.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 63.5 t -63.81 -42.32 95.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 122.264 1.031 . . . . 0.0 108.393 176.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -68.29 -28.32 67.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.735 -1.575 . . . . 0.0 113.597 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 20.3 m -157.59 73.53 4.25 Favored Pre-proline 0 N--CA 1.472 0.645 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -72.25 143.37 39.38 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 115.194 -2.737 . . . . 0.0 112.204 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -137.28 100.65 4.31 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.689 0.756 . . . . 0.0 110.563 -178.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -47.28 91.58 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.867 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -57.59 -31.85 66.59 Favored 'General case' 0 CA--C 1.506 -0.716 0 O-C-N 123.301 0.376 . . . . 0.0 110.04 -177.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -70.88 -39.4 72.87 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -177.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.1 -48.96 69.2 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.86 -42.38 79.65 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.489 0.185 . . . . 0.0 111.314 -175.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -67.01 -36.8 82.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.44 0.638 . . . . 0.0 112.125 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.407 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.78 -45.86 67.05 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.45 -44.1 80.14 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.746 -1.116 . . . . 0.0 111.086 178.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -63.41 -37.39 87.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 119.156 0.889 . . . . 0.0 112.616 -177.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -70.51 -44.84 66.76 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 177.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.31 -35.79 67.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.237 0.541 . . . . 0.0 111.323 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.62 -20.35 69.95 Favored Glycine 0 C--O 1.24 0.506 0 N-CA-C 114.779 0.671 . . . . 0.0 114.779 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.2 t -107.14 -16.01 14.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 117.338 0.569 . . . . 0.0 110.081 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -65.47 145.53 56.01 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.474 ' O ' HD13 ' A' ' 512' ' ' ILE . 28.2 tt0 -80.09 79.59 6.62 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-O 122.542 1.163 . . . . 0.0 109.167 178.21 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.827 HG21 HD22 ' A' ' 546' ' ' LEU . 29.6 m -94.07 47.18 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 CA-C-O 122.991 1.377 . . . . 0.0 107.628 179.426 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.21 173.69 3.02 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 -178.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 13.8 m -48.32 -34.98 11.44 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 -173.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -54.86 -44.19 73.79 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 177.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.474 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -87.68 -38.74 12.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.418 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.84 -36.75 79.91 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -175.885 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -65.88 -32.29 73.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.385 0.612 . . . . 0.0 111.983 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -93.24 -1.64 55.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.493 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -129.46 44.94 2.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.815 0.817 . . . . 0.0 112.099 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 23.7 p -65.51 -28.18 69.01 Favored 'General case' 0 C--N 1.32 -0.678 0 O-C-N 121.746 -0.596 . . . . 0.0 112.132 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -66.74 -27.21 67.43 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.663 0.744 . . . . 0.0 111.838 177.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.7 t -70.72 -43.6 77.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.8 t -63.53 -37.17 78.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.32 -33.71 76.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.918 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 80.1 m -78.69 -40.27 34.34 Favored 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.547 HD23 HD11 ' A' ' 526' ' ' ILE . 40.2 mt -57.61 -35.4 70.4 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.124 0.488 . . . . 0.0 110.933 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.04 -26.92 68.78 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.895 -0.503 . . . . 0.0 111.886 175.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -76.47 -43.38 40.1 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.547 HD11 HD23 ' A' ' 523' ' ' LEU . 1.2 pt -78.81 -22.08 12.9 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.988 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -177.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.468 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -64.49 -12.1 40.63 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 175.317 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -121.14 19.32 11.56 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.821 0.448 . . . . 0.0 110.474 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.7 112.78 3.0 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.494 0.664 . . . . 0.0 112.497 -174.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -78.37 -31.42 48.48 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.55 -26.96 65.68 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -175.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.6 122.35 10.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.164 0.507 . . . . 0.0 112.354 176.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -64.15 -40.4 96.07 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -61.85 -40.86 96.82 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.552 0.692 . . . . 0.0 109.986 -176.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.3 t -58.03 -43.21 84.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.089 176.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 32.5 ttm -59.73 -48.64 80.85 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-O 120.8 0.333 . . . . 0.0 110.852 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -68.14 -45.72 72.82 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -178.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 44.7 tptt -69.51 -38.5 77.61 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 118.931 -1.107 . . . . 0.0 110.482 -177.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -60.13 -38.93 84.54 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.468 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.62 -48.91 70.65 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.716 -1.129 . . . . 0.0 113.981 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -40.5 87.79 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 61.9 t -70.59 -53.02 24.16 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.867 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.563 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -53.8 -45.1 70.63 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 122.372 0.269 . . . . 0.0 111.22 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 25.3 m -65.05 -36.98 86.08 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.171 0.588 . . . . 0.0 111.157 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 37.2 mtt85 -62.08 -29.96 70.67 Favored 'General case' 0 C--O 1.216 -0.674 0 O-C-N 121.563 -0.711 . . . . 0.0 110.59 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.827 HD22 HG21 ' A' ' 508' ' ' VAL . 4.7 mt -76.38 -31.12 57.82 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -175.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -42.49 99.17 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 175.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 18.0 m . . . . . 0 C--N 1.319 -0.75 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 178.553 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.6 m . . . . . 0 C--O 1.223 -0.303 0 CA-C-O 120.959 0.409 . . . . 0.0 111.798 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 41.1 t -53.63 -46.09 60.67 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.947 0 O-C-N 122.016 -0.427 . . . . 0.0 112.103 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.03 -34.14 77.73 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -67.54 -40.2 85.03 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -73.07 -32.72 65.21 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.228 -177.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.419 HD23 HD21 ' A' ' 503' ' ' LEU . 1.9 tm? -57.43 -39.34 76.02 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.062 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -53.2 -39.83 63.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.87 0.304 . . . . 0.0 110.268 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -71.72 -57.28 4.51 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.866 177.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.79 -45.88 78.12 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -176.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -59.31 -42.01 90.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.9 m -65.14 -37.78 88.51 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 123.13 0.268 . . . . 0.0 111.476 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.49 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 46.5 mm-40 -64.74 -37.05 86.3 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.961 -0.695 . . . . 0.0 110.279 178.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -59.1 -42.58 86.99 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.063 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -62.51 -46.87 86.46 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -65.35 -33.13 75.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.89 0.376 . . . . 0.0 111.224 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.01 -17.32 64.61 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.6 mt -110.48 12.0 22.99 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -176.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -55.3 130.06 40.89 Favored 'General case' 0 C--O 1.208 -1.094 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 177.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 51.0 t -63.01 -40.49 89.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 122.267 1.032 . . . . 0.0 108.88 178.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.17 -29.87 69.68 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.756 -1.565 . . . . 0.0 113.011 -178.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 18.1 t -161.45 78.97 2.16 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.56 146.17 34.27 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 118.11 -0.794 . . . . 0.0 112.767 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -137.28 101.17 4.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.679 0.752 . . . . 0.0 110.804 -179.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.407 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.7 OUTLIER -60.05 -45.26 95.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -179.149 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -61.76 -31.08 71.25 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -69.19 -41.3 77.33 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -178.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.433 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -65.0 -48.29 74.48 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.004 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 73.7 mt -56.69 -44.96 82.01 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.18 -41.0 97.93 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.799 0.809 . . . . 0.0 110.053 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.49 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.11 -48.16 68.97 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.339 0.59 . . . . 0.0 109.847 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.433 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.5 -45.76 84.54 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.379 178.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -63.25 -35.37 80.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 119.006 0.821 . . . . 0.0 112.475 -176.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -71.82 -43.8 64.98 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 177.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.419 HD21 HD23 ' A' ' 475' ' ' LEU . 0.2 OUTLIER -56.18 -33.86 65.67 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.511 0.672 . . . . 0.0 110.657 177.736 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.1 -16.42 66.6 Favored Glycine 0 C--O 1.239 0.411 0 CA-C-O 119.204 -0.775 . . . . 0.0 114.526 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.8 t -113.9 -14.3 12.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 118.042 0.921 . . . . 0.0 110.889 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.5 mt -66.48 145.97 55.06 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.877 -0.514 . . . . 0.0 109.829 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.416 ' O ' HD13 ' A' ' 512' ' ' ILE . 30.0 tt0 -79.11 84.42 5.09 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 122.836 1.303 . . . . 0.0 109.566 178.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.975 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -96.59 48.76 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-O 123.18 1.467 . . . . 0.0 107.996 -178.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.5 t -66.84 172.23 4.57 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 -178.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 2.7 m -49.26 -34.88 16.19 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -173.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -54.72 -44.63 73.67 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 177.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -86.12 -41.66 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.43 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.63 -38.86 82.51 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -175.32 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -69.33 -31.94 70.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.824 -177.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -88.42 -3.96 58.73 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.232 177.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -127.52 45.34 2.75 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.858 0.837 . . . . 0.0 112.465 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 17.5 p -64.91 -28.71 69.72 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 121.699 -0.626 . . . . 0.0 112.568 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -69.7 -22.5 63.41 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.503 0.668 . . . . 0.0 112.09 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 87.9 t -71.55 -45.17 69.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 177.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 50.6 t -62.94 -36.79 77.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.57 79.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.407 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.1 m -77.63 -39.08 46.42 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 118.47 0.577 . . . . 0.0 109.698 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.687 HD23 HD11 ' A' ' 526' ' ' ILE . 48.8 mt -59.11 -31.89 69.34 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.064 0.459 . . . . 0.0 111.464 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -64.73 -29.11 70.08 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.757 -0.589 . . . . 0.0 111.199 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -74.58 -42.59 58.46 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.687 HD11 HD23 ' A' ' 523' ' ' LEU . 1.3 pt -78.8 -22.42 12.92 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.905 0 N-CA-C 114.919 1.452 . . . . 0.0 114.919 -176.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.436 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -60.92 -18.8 58.83 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-O 120.845 0.355 . . . . 0.0 111.649 176.151 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -118.85 19.51 13.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.18 0.592 . . . . 0.0 111.508 178.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.403 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 14.0 t80 -66.8 118.48 10.38 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 122.661 0.384 . . . . 0.0 111.168 -178.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 44.1 mttp -83.13 -26.24 31.16 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 116.003 1.853 . . . . 0.0 116.003 -176.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.403 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -64.03 -40.57 96.62 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.614 -0.435 . . . . 0.0 111.564 -175.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -133.02 116.2 16.09 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.189 -178.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.9 tptt -57.48 -43.44 84.09 Favored 'General case' 0 C--O 1.21 -1.003 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -52.3 -45.91 65.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.8 t -58.52 -44.08 88.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.2 ttp -64.17 -44.31 92.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.32 -48.43 78.05 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.849 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.0 tptt -71.67 -38.62 70.63 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 118.315 -1.354 . . . . 0.0 111.961 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.04 -40.04 79.9 Favored 'General case' 0 C--O 1.212 -0.899 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.64 -51.07 68.7 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.09 178.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.59 -43.6 89.56 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 60.3 t -67.86 -51.27 51.8 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.809 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.233 -177.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -54.67 -44.87 73.7 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.653 0.263 . . . . 0.0 110.41 -177.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 40.5 m -63.81 -38.6 91.72 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 123.641 0.776 . . . . 0.0 111.315 179.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 66.2 mtt180 -61.69 -28.58 69.5 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 121.62 -0.675 . . . . 0.0 111.061 176.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.975 HD22 HG21 ' A' ' 508' ' ' VAL . 5.8 mt -76.52 -31.83 57.89 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 -176.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.25 -38.58 87.21 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.239 177.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 C--N 1.321 -0.663 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 178.275 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.9 m . . . . . 0 C--O 1.224 -0.251 0 CA-C-O 120.975 0.417 . . . . 0.0 111.403 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.454 HG13 ' HB3' ' A' ' 506' ' ' LEU . 44.4 t -54.84 -46.92 75.43 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.049 0 O-C-N 122.047 -0.408 . . . . 0.0 111.539 179.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.439 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.5 pt-20 -61.03 -34.21 74.5 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -68.19 -41.42 81.44 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.15 0.976 . . . . 0.0 108.453 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -73.32 -34.89 65.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.927 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.563 HD21 HG21 ' A' ' 519' ' ' VAL . 2.6 tt -57.57 -37.99 74.09 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.663 178.355 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.36 -38.65 80.97 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.286 -0.565 . . . . 0.0 110.205 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -68.44 -53.34 24.24 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 176.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.27 -45.77 87.25 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.423 ' CG ' HG22 ' A' ' 519' ' ' VAL . 17.6 t-160 -58.8 -42.84 90.05 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 65.7 m -63.59 -41.71 98.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 119.573 -0.251 . . . . 0.0 111.195 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.442 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 60.9 mm-40 -63.79 -40.84 97.63 Favored 'General case' 0 CA--C 1.501 -0.92 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.28 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.54 -45.8 71.29 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.039 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -68.08 -39.13 82.99 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -67.75 -31.38 71.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.998 0.428 . . . . 0.0 110.408 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.06 -18.61 64.72 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 122.633 0.373 . . . . 0.0 111.807 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 27.0 mt -107.39 12.16 28.27 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -54.91 129.77 38.79 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.0 t -61.25 -40.08 84.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 122.474 1.13 . . . . 0.0 108.852 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -66.33 -28.76 68.92 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 113.398 -1.728 . . . . 0.0 112.676 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 22.9 t -159.59 76.99 2.95 Favored Pre-proline 0 C--O 1.24 0.577 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -73.43 141.61 31.91 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 114.979 -2.881 . . . . 0.0 112.29 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -137.27 105.1 5.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.491 0.662 . . . . 0.0 110.444 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.81 -44.18 96.99 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -58.71 -32.69 69.41 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -178.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 22.7 ttp180 -68.51 -41.0 80.59 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.429 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -68.0 -48.98 64.27 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.624 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.89 -44.07 81.95 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -61.91 -38.22 87.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.654 0.74 . . . . 0.0 111.704 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.442 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -70.93 -47.46 58.93 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.499 0.666 . . . . 0.0 109.704 178.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.429 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.93 -47.89 73.83 Favored 'General case' 0 N--CA 1.428 -1.537 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.115 178.743 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -61.4 -35.74 78.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.434 0.902 . . . . 0.0 113.434 -175.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.65 -46.13 59.93 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.49 -33.87 68.48 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.337 0.589 . . . . 0.0 109.872 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.64 -16.65 68.05 Favored Glycine 0 C--O 1.239 0.429 0 N-CA-C 115.034 0.774 . . . . 0.0 115.034 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.4 t -112.76 -7.93 13.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 118.136 0.968 . . . . 0.0 111.017 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.454 ' HB3' HG13 ' A' ' 471' ' ' VAL . 3.7 mt -71.89 148.93 45.62 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.424 ' O ' HD13 ' A' ' 512' ' ' ILE . 26.1 tt0 -79.4 84.33 5.32 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 122.757 1.265 . . . . 0.0 109.452 178.027 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.889 HG21 HD22 ' A' ' 546' ' ' LEU . 30.2 m -98.3 48.3 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 CA-C-O 123.028 1.394 . . . . 0.0 107.93 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.0 t -66.24 172.44 3.89 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 -178.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 20.2 m -49.32 -33.25 12.84 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -174.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -55.48 -44.35 76.4 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 178.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.424 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -86.63 -41.4 14.89 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 CA-C-O 121.502 0.668 . . . . 0.0 109.348 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.455 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.35 -38.47 80.48 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -176.054 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -63.85 -31.37 72.52 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.641 0.734 . . . . 0.0 112.446 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -95.38 -5.87 42.29 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.447 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -127.91 39.25 3.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.465 0.65 . . . . 0.0 111.296 -178.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.8 p -62.56 -25.48 68.08 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -178.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.36 -31.78 73.02 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.424 0.631 . . . . 0.0 112.155 178.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.563 HG21 HD21 ' A' ' 475' ' ' LEU . 41.3 t -71.15 -40.87 75.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.4 t -62.5 -37.75 79.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 178.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.69 92.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.38 177.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.5 m -73.68 -37.99 65.05 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 118.383 0.538 . . . . 0.0 110.536 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.686 HD23 HD11 ' A' ' 526' ' ' ILE . 68.6 mt -59.36 -34.51 72.49 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.929 0.395 . . . . 0.0 110.815 178.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -65.57 -29.04 69.6 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.807 -0.558 . . . . 0.0 111.212 175.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -71.21 -45.88 62.38 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 120.816 0.341 . . . . 0.0 110.986 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.686 HD11 HD23 ' A' ' 523' ' ' LEU . 5.3 pt -78.79 -20.4 12.98 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.987 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -177.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.446 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.97 -12.48 38.08 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 121.678 -0.638 . . . . 0.0 112.537 176.919 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -118.83 15.78 13.47 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 122.527 0.331 . . . . 0.0 111.57 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.411 ' CE2' ' HB3' ' A' ' 531' ' ' ALA . 18.2 t80 -63.32 122.85 17.21 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.203 0.525 . . . . 0.0 112.005 -176.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -92.38 -26.3 18.11 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 116.484 2.031 . . . . 0.0 116.484 -177.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.411 ' HB3' ' CE2' ' A' ' 529' ' ' TYR . . . -62.7 -42.29 99.56 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.719 0.771 . . . . 0.0 110.559 -176.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -129.6 111.88 13.15 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -61.02 -38.05 84.73 Favored 'General case' 0 C--O 1.209 -1.038 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.731 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -57.15 -41.96 80.11 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 55.0 t -56.45 -43.28 77.4 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 6.9 ttp -66.47 -40.11 89.17 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 122.369 0.268 . . . . 0.0 110.759 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.24 -51.38 63.92 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 123.086 0.241 . . . . 0.0 110.368 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -70.16 -38.29 75.42 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 119.401 -0.92 . . . . 0.0 111.239 -177.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . 0.463 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -58.35 -40.71 82.92 Favored 'General case' 0 C--O 1.213 -0.868 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.446 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.51 -47.79 74.75 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.896 -1.047 . . . . 0.0 112.854 179.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -42.59 92.13 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.1 t -70.59 -49.72 50.2 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.085 0 C-N-CA 122.883 0.473 . . . . 0.0 111.61 -177.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -55.63 -44.97 77.62 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -178.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.3 m -66.71 -36.29 82.15 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 122.792 0.437 . . . . 0.0 110.889 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 9.3 mtt85 -58.84 -30.21 67.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.979 -0.451 . . . . 0.0 110.263 175.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.889 HD22 HG21 ' A' ' 508' ' ' VAL . 8.7 mt -76.63 -34.79 58.32 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -176.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -30.45 70.73 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.674 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 C--N 1.318 -0.796 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.428 177.306 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.2 m . . . . . 0 C--O 1.223 -0.314 0 N-CA-C 112.245 0.461 . . . . 0.0 112.245 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.403 HG13 ' HB3' ' A' ' 506' ' ' LEU . 41.9 t -53.9 -46.75 64.59 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.429 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.6 pt-20 -62.09 -34.16 75.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.74 0.305 . . . . 0.0 111.566 -177.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.47 -41.9 79.49 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -73.17 -34.09 65.83 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.281 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.552 HD21 HG21 ' A' ' 519' ' ' VAL . 3.0 tt -58.95 -35.87 73.87 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.481 178.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -59.11 -40.18 84.56 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.906 -0.718 . . . . 0.0 109.647 178.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -67.29 -54.16 23.25 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.151 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -45.18 81.53 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.402 ' CG ' HG22 ' A' ' 519' ' ' VAL . 18.8 t-160 -58.89 -41.8 88.03 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 57.4 m -65.3 -39.31 92.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 119.406 -0.331 . . . . 0.0 111.649 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.506 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 58.5 mm-40 -64.49 -41.01 96.71 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.846 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.88 -47.22 75.78 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.214 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 177.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -65.79 -38.43 88.98 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -67.3 -34.01 76.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.866 0.365 . . . . 0.0 110.414 177.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.6 -17.45 64.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.0 mt -107.28 11.93 28.71 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -177.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -57.2 129.69 42.88 Favored 'General case' 0 CA--C 1.497 -1.081 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 16.1 m -71.32 -19.53 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.079 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.942 -178.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.84 -27.91 30.51 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 113.47 -1.695 . . . . 0.0 110.823 -179.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 77.4 p -163.76 79.19 1.57 Allowed Pre-proline 0 C--O 1.241 0.623 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.897 -176.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -73.49 147.84 41.68 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 115.493 -2.538 . . . . 0.0 112.782 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -137.28 100.09 4.16 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.751 0.786 . . . . 0.0 109.726 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.425 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.4 OUTLIER -60.5 -47.6 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.838 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -177.666 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -60.69 -30.15 69.75 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 -177.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.2 ttt180 -68.32 -41.59 80.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.448 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.38 -47.74 78.1 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.17 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 86.2 mt -57.37 -44.47 84.45 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -176.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -38.49 89.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.772 0.796 . . . . 0.0 110.115 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.16 -48.32 62.58 Favored 'General case' 0 C--N 1.321 -0.631 0 O-C-N 121.693 -0.629 . . . . 0.0 110.078 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.448 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -56.18 -48.25 76.72 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.882 178.255 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -62.15 -35.71 79.61 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -175.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -72.78 -43.09 63.24 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 119.02 -1.072 . . . . 0.0 108.602 177.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.48 -35.82 70.67 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.237 0.541 . . . . 0.0 110.325 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.8 -18.81 68.85 Favored Glycine 0 C--O 1.242 0.602 0 N-CA-C 114.996 0.758 . . . . 0.0 114.996 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.8 t -109.27 -10.31 14.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 117.717 0.758 . . . . 0.0 110.293 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.403 ' HB3' HG13 ' A' ' 471' ' ' VAL . 1.4 mt -71.16 148.89 46.92 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.452 ' O ' HD13 ' A' ' 512' ' ' ILE . 32.6 tt0 -79.76 84.26 5.59 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 122.261 1.029 . . . . 0.0 109.264 178.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.921 HG21 HD22 ' A' ' 546' ' ' LEU . 35.5 m -98.54 47.73 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.163 0 CA-C-O 123.344 1.545 . . . . 0.0 108.188 -178.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 13.3 t -68.16 173.73 4.47 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.5 m -49.37 -33.76 14.41 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -173.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -53.91 -43.43 69.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 177.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.452 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.63 -41.77 14.31 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 CA-C-O 121.979 0.895 . . . . 0.0 109.431 179.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -39.47 81.3 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -175.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -67.55 -32.43 73.19 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.649 -178.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -89.11 -10.02 48.89 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.935 -0.306 . . . . 0.0 111.202 179.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -125.65 40.99 3.62 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.484 0.659 . . . . 0.0 112.163 -176.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 23.8 p -63.51 -24.45 67.82 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -62.15 -31.82 72.36 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.022 0.439 . . . . 0.0 112.024 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.552 HG21 HD21 ' A' ' 475' ' ' LEU . 23.6 t -71.11 -40.27 75.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 49.0 t -62.56 -36.83 76.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 178.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.82 -37.52 87.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.825 177.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.5 m -75.89 -38.38 57.87 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 118.531 0.605 . . . . 0.0 110.017 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.507 HD23 HD11 ' A' ' 526' ' ' ILE . 46.4 mt -57.78 -34.96 70.16 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.951 0.405 . . . . 0.0 111.417 178.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -65.33 -29.09 69.79 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 121.976 -0.453 . . . . 0.0 111.376 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -73.7 -44.32 56.82 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.733 0.301 . . . . 0.0 111.189 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.507 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.23 -22.14 13.46 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.877 0 N-CA-C 114.323 1.231 . . . . 0.0 114.323 -176.783 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -62.6 -16.03 54.4 Favored 'General case' 0 C--O 1.214 -0.793 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 176.555 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -118.65 19.28 13.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.044 0.538 . . . . 0.0 111.61 177.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -69.5 95.11 0.8 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -63.64 -27.59 69.34 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -178.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.5 -31.06 72.11 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -176.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -144.77 108.24 4.63 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.7 tptt -53.96 -46.27 71.57 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.043 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -55.92 -43.42 77.35 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.038 0.446 . . . . 0.0 111.992 -176.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.53 -44.76 85.54 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.491 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.3 ttp -64.72 -42.85 94.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 119.283 -0.389 . . . . 0.0 110.279 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -64.52 -48.36 75.41 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.828 179.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -68.88 -39.16 79.96 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 118.978 -1.089 . . . . 0.0 110.908 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.18 83.84 Favored 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 109.084 -0.709 . . . . 0.0 109.084 177.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.99 -48.21 71.99 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.868 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -42.12 93.64 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.9 t -70.52 -51.43 37.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.921 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.578 -178.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -54.07 -44.84 71.46 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 -177.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.7 m -66.17 -34.84 78.96 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 123.111 0.564 . . . . 0.0 111.638 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 26.1 mtt85 -62.45 -31.18 71.86 Favored 'General case' 0 C--O 1.217 -0.648 0 O-C-N 121.771 -0.581 . . . . 0.0 109.698 175.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.921 HD22 HG21 ' A' ' 508' ' ' VAL . 5.7 mt -75.03 -34.69 61.91 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -176.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -59.79 -33.43 71.71 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.392 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.3 m . . . . . 0 C--N 1.322 -0.589 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 179.753 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.1 m . . . . . 0 C--O 1.224 -0.255 0 CA-C-O 121.307 0.575 . . . . 0.0 112.145 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.46 HG13 ' HB3' ' A' ' 506' ' ' LEU . 53.3 t -56.08 -47.23 80.74 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.771 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -64.08 -34.24 77.58 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -67.27 -43.64 81.33 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.991 0.901 . . . . 0.0 108.783 177.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 24.8 mttt -69.04 -34.27 74.94 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.0 -178.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.412 HD21 HG21 ' A' ' 519' ' ' VAL . 1.5 tm? -58.63 -36.98 74.93 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.355 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -54.92 -40.78 70.23 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.04 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 62.6 tttt -68.97 -55.06 12.06 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 176.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.23 -46.87 79.37 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -176.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -60.88 -40.61 93.65 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.0 m -63.98 -41.89 97.39 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.549 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.46 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.5 mm-40 -63.12 -42.89 99.61 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 118.004 0.365 . . . . 0.0 110.872 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.63 -47.49 72.49 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -67.2 -37.32 83.47 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -177.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -67.15 -33.73 76.05 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.0 -17.36 64.89 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 27.9 mt -107.06 12.08 28.94 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -56.05 132.42 50.05 Favored 'General case' 0 C--O 1.21 -1.006 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 177.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.84 -41.1 91.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 175.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -65.55 -28.76 69.39 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.056 -1.884 . . . . 0.0 113.782 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 19.0 m -159.93 72.85 3.15 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -176.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.41 141.49 28.58 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 114.18 -3.413 . . . . 0.0 112.27 179.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -137.27 100.15 4.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.579 0.704 . . . . 0.0 110.214 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.416 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.3 OUTLIER -58.16 -46.55 88.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.433 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -57.87 -31.93 67.19 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -178.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -70.82 -39.88 72.79 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 -176.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.42 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.42 -48.61 72.21 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.6 mt -56.83 -42.94 80.52 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -176.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -65.0 -38.44 90.97 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.424 0.63 . . . . 0.0 111.836 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.46 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -68.42 -47.53 67.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.579 0.704 . . . . 0.0 109.582 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.42 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -55.07 -48.11 73.95 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.875 177.743 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -63.96 -34.12 77.26 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -175.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -69.56 -46.88 65.37 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 176.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.408 HD21 HD23 ' A' ' 475' ' ' LEU . 1.1 tm? -58.44 -33.6 69.89 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.191 0.52 . . . . 0.0 110.901 -178.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.81 -18.29 63.95 Favored Glycine 0 C--O 1.235 0.191 0 CA-C-O 119.451 -0.638 . . . . 0.0 114.359 179.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.1 t -111.36 -12.44 14.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.911 0.856 . . . . 0.0 110.466 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.46 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.9 mt -68.87 146.48 52.79 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.982 -0.448 . . . . 0.0 110.228 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.416 ' O ' HD13 ' A' ' 512' ' ' ILE . 36.5 tt0 -79.22 84.4 5.18 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 122.762 1.267 . . . . 0.0 110.21 178.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.898 HG21 HD22 ' A' ' 546' ' ' LEU . 27.0 m -96.19 45.8 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 CA-C-O 122.8 1.286 . . . . 0.0 109.11 -178.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.1 t -66.47 171.31 5.08 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -177.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.5 m -49.26 -30.19 6.9 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -174.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -55.43 -45.71 76.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.522 0.201 . . . . 0.0 111.475 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -88.75 -40.3 13.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.283 0.563 . . . . 0.0 109.819 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.499 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.91 -34.93 75.42 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -174.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -64.62 -31.68 73.01 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.786 0.803 . . . . 0.0 111.817 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -95.34 -3.04 47.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.899 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -126.19 38.91 4.05 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.163 0.506 . . . . 0.0 110.526 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.5 p -63.81 -29.27 70.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -63.58 -26.74 68.83 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.586 0.708 . . . . 0.0 111.83 177.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.412 HG21 HD21 ' A' ' 475' ' ' LEU . 38.4 t -71.66 -42.85 71.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.2 t -62.82 -35.96 73.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.11 85.69 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.06 176.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 98.0 m -77.91 -38.54 45.44 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 118.958 0.799 . . . . 0.0 110.011 -179.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.531 HD23 HD11 ' A' ' 526' ' ' ILE . 45.0 mt -57.52 -35.13 69.87 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.01 0.433 . . . . 0.0 111.393 178.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -64.95 -29.03 69.93 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.948 -0.47 . . . . 0.0 111.538 175.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -73.43 -45.14 56.26 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.768 0.318 . . . . 0.0 111.259 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.531 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -77.06 -23.4 14.82 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.923 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -176.405 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.439 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.2 OUTLIER -60.2 -19.32 53.69 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 176.413 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -118.64 19.32 13.27 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.093 0.557 . . . . 0.0 111.897 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -63.59 109.68 1.74 Allowed 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -176.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -72.51 -29.27 63.46 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -177.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.65 -24.84 64.58 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -174.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -150.79 119.25 6.44 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.774 -0.371 . . . . 0.0 110.422 178.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -61.38 -45.94 92.27 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.121 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -56.89 -40.36 76.1 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.185 0.517 . . . . 0.0 111.515 -175.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.7 t -56.05 -45.09 80.34 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -64.55 -43.93 92.37 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 119.12 -0.467 . . . . 0.0 110.08 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.54 -47.59 78.21 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.305 -0.558 . . . . 0.0 111.99 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -68.72 -40.28 80.0 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 119.627 -0.829 . . . . 0.0 110.934 -178.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.94 86.89 Favored 'General case' 0 C--O 1.213 -0.852 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.439 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.12 -48.79 74.71 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.354 -0.839 . . . . 0.0 113.15 179.087 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -43.96 95.0 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 59.0 t -68.69 -50.13 58.14 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.676 -178.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -54.68 -45.03 73.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.657 0.265 . . . . 0.0 110.374 -177.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 10.3 m -67.15 -34.13 76.92 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.755 0.312 . . . . 0.0 111.273 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -60.76 -28.94 69.09 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.613 -0.68 . . . . 0.0 109.732 175.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.898 HD22 HG21 ' A' ' 508' ' ' VAL . 9.2 mt -76.39 -34.24 58.87 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -174.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -29.09 70.48 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.418 178.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.6 m . . . . . 0 C--N 1.317 -0.827 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.456 176.822 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 8.9 m . . . . . 0 C--O 1.224 -0.251 0 N-CA-C 113.091 0.775 . . . . 0.0 113.091 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 35.6 t -53.86 -47.13 64.14 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.132 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.1 pt-20 -64.7 -34.31 78.01 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 120.718 0.294 . . . . 0.0 111.41 -176.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -67.25 -41.33 85.78 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -73.27 -33.61 65.35 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.891 -176.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.488 HD21 HG21 ' A' ' 519' ' ' VAL . 5.0 tt -56.74 -35.58 68.77 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.005 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -55.5 -41.02 72.49 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.253 0.479 . . . . 0.0 110.634 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -66.38 -54.68 21.59 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 177.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -47.23 85.18 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -176.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.477 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.6 t-160 -58.98 -43.08 91.34 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 62.2 m -64.13 -39.03 93.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 117.752 0.251 . . . . 0.0 111.619 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.401 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.3 mm-40 -64.23 -37.26 86.84 Favored 'General case' 0 CA--C 1.501 -0.935 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.595 179.001 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.14 -44.0 86.62 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.993 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 178.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.3 mmtt -62.94 -43.08 99.76 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -67.59 -34.12 76.38 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.73 0.3 . . . . 0.0 111.02 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.84 -15.29 63.52 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 29.7 mt -111.46 12.17 21.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.526 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -58.04 141.4 50.05 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 121.96 0.886 . . . . 0.0 109.562 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 70.7 t -65.42 -36.29 77.33 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 CA-C-N 113.86 -1.518 . . . . 0.0 107.808 174.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -74.92 -29.47 60.97 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.127 -1.851 . . . . 0.0 112.238 -173.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 10.2 t -165.98 79.54 1.14 Allowed Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.589 -175.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -73.07 142.5 34.52 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 115.082 -2.812 . . . . 0.0 112.163 176.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.4 t0 -137.13 100.34 4.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.451 0.643 . . . . 0.0 110.383 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.4 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.8 OUTLIER -55.5 -46.01 78.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -178.894 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -32.61 68.91 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-O 121.974 0.892 . . . . 0.0 109.933 -176.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -70.41 -40.55 73.8 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.269 -1.332 . . . . 0.0 108.633 -176.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.415 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.59 -50.31 65.57 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 175.305 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.7 mt -56.82 -42.83 80.3 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -65.52 -37.89 88.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.585 0.707 . . . . 0.0 111.655 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.77 -46.88 64.83 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.622 0.725 . . . . 0.0 109.694 178.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.415 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.92 -49.34 71.53 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.873 177.677 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -59.32 -36.58 75.91 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.8 -44.59 61.32 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.4 -34.79 72.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.059 0.457 . . . . 0.0 110.459 -178.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.46 -16.48 65.27 Favored Glycine 0 C--O 1.24 0.491 0 N-CA-C 115.359 0.904 . . . . 0.0 115.359 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.4 t -113.01 -12.19 13.26 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.413 0.607 . . . . 0.0 110.633 -179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -67.64 149.19 50.38 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.428 ' O ' HD13 ' A' ' 512' ' ' ILE . 37.1 tt0 -77.28 84.51 3.73 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-O 122.537 1.16 . . . . 0.0 108.979 177.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.87 HG21 HD22 ' A' ' 546' ' ' LEU . 26.9 m -98.73 47.59 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 CA-C-O 122.96 1.362 . . . . 0.0 108.194 -178.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.0 t -66.21 173.43 3.16 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 -179.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.8 m -49.33 -33.65 13.87 Favored 'General case' 0 C--O 1.211 -0.949 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -174.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -55.35 -45.44 76.47 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.202 -0.311 . . . . 0.0 111.771 177.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.428 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.1 mp -83.76 -42.52 17.4 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.424 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.92 -37.32 79.11 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -175.746 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -66.78 -32.89 74.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.477 0.18 . . . . 0.0 111.401 -179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -88.87 -6.44 57.32 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.843 179.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -129.89 44.35 2.98 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -178.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 32.3 p -64.88 -24.76 67.63 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.84 -33.26 75.59 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 122.399 1.095 . . . . 0.0 112.317 178.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.488 HG21 HD21 ' A' ' 475' ' ' LEU . 91.5 t -67.69 -43.18 86.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . 0.412 HG21 HD13 ' A' ' 513' ' ' LEU . 40.4 t -64.28 -37.45 79.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.91 -34.5 78.1 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.642 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 87.4 m -76.59 -39.64 51.98 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.58 HD23 HD11 ' A' ' 526' ' ' ILE . 51.9 mt -58.62 -34.79 71.55 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.1 0.476 . . . . 0.0 110.926 179.025 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -64.65 -29.18 70.18 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.912 -0.493 . . . . 0.0 111.32 175.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -73.05 -44.75 60.27 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 122.283 -0.261 . . . . 0.0 111.654 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.58 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.43 -20.57 13.27 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.905 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 -176.362 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.4 OUTLIER -62.19 -17.41 58.04 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 177.165 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -118.72 19.31 13.21 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.174 0.59 . . . . 0.0 112.128 176.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.434 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 13.2 t80 -63.8 117.68 7.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.06 0.457 . . . . 0.0 112.211 -177.482 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -75.97 -31.47 59.03 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.434 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -64.11 -41.73 97.14 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -173.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -133.21 118.27 18.42 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -178.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -58.8 -45.7 89.27 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.362 178.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -56.07 -41.75 75.59 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -176.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 68.6 t -56.57 -44.94 81.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.658 0 O-C-N 121.87 -0.519 . . . . 0.0 109.813 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.7 ttp -64.07 -43.89 94.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 119.167 -0.444 . . . . 0.0 109.846 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.89 -47.39 77.98 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.326 -0.55 . . . . 0.0 112.085 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -70.11 -37.96 75.5 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 119.089 -1.045 . . . . 0.0 111.253 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.54 -40.65 87.93 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.41 -49.23 72.35 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.543 179.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.36 -43.23 88.3 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 55.2 t -70.32 -49.98 49.87 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.041 0 C-N-CA 122.924 0.49 . . . . 0.0 111.318 -177.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -55.44 -45.82 76.81 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -178.144 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 17.6 m -66.18 -35.18 79.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.515 0.674 . . . . 0.0 111.029 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 13.1 mtt85 -60.82 -30.32 70.01 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.993 -0.442 . . . . 0.0 109.952 174.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.87 HD22 HG21 ' A' ' 508' ' ' VAL . 8.3 mt -76.55 -34.48 58.5 Favored 'General case' 0 C--O 1.208 -1.119 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 -176.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -28.19 69.22 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.587 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 25.2 m . . . . . 0 C--N 1.316 -0.877 0 CA-C-N 114.67 -1.15 . . . . 0.0 111.946 177.754 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 7.3 m . . . . . 0 C--O 1.223 -0.322 0 N-CA-C 112.399 0.518 . . . . 0.0 112.399 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.496 HG23 ' HB3' ' A' ' 506' ' ' LEU . 0.1 OUTLIER -53.06 -54.21 18.23 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.137 0 CA-C-O 121.967 0.889 . . . . 0.0 112.134 -179.627 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -54.24 -34.24 60.24 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 113.744 -1.571 . . . . 0.0 113.423 178.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -69.85 -43.8 71.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 122.531 1.157 . . . . 0.0 108.167 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -70.06 -32.77 71.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.564 -177.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.722 HD21 HG21 ' A' ' 519' ' ' VAL . 2.5 tt -56.99 -35.66 69.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.447 178.191 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -58.5 -40.75 83.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.523 0.601 . . . . 0.0 109.92 178.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -66.85 -54.89 17.86 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 110.334 -0.247 . . . . 0.0 110.334 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -43.31 90.98 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.481 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.5 t-160 -57.31 -44.05 83.78 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.9 m -63.95 -38.5 91.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.485 0.18 . . . . 0.0 111.485 -179.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -63.3 -38.65 91.98 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.28 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.9 mt -58.22 -43.95 86.86 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -62.85 -44.74 95.32 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -178.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -66.36 -31.8 72.8 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.023 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.2 -18.39 65.23 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.897 0.702 . . . . 0.0 112.897 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . 0.41 HD11 ' CG2' ' A' ' 526' ' ' ILE . 20.9 mt -106.84 12.14 29.29 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -177.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -54.72 130.15 39.52 Favored 'General case' 0 C--O 1.208 -1.119 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 178.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 55.8 t -63.5 -42.2 95.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 122.056 0.931 . . . . 0.0 109.471 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -67.6 -30.86 70.56 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 113.979 -1.464 . . . . 0.0 112.975 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 13.8 t -160.08 77.55 2.73 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.002 -175.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.61 149.23 34.01 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 117.123 -1.451 . . . . 0.0 112.383 179.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -137.21 97.77 3.57 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.857 0.836 . . . . 0.0 110.078 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.7 OUTLIER -58.22 -46.36 88.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -179.212 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -59.74 -31.38 69.58 Favored 'General case' 0 CA--C 1.504 -0.811 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -177.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -69.08 -41.6 77.32 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.53 -47.89 77.12 Favored 'General case' 0 C--O 1.21 -1.021 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 175.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 84.6 mt -57.68 -44.06 85.52 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 118.045 0.384 . . . . 0.0 111.346 -176.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -63.07 -40.88 99.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.735 0.779 . . . . 0.0 110.901 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.14 -46.65 73.44 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.762 0.791 . . . . 0.0 109.529 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.401 HD23 ' HB3' ' A' ' 538' ' ' LYS . 0.0 OUTLIER -56.11 -51.16 68.91 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.337 178.339 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -61.44 -35.66 78.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -175.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.26 -43.25 64.6 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 118.775 -1.17 . . . . 0.0 108.473 177.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -33.31 67.6 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.359 0.599 . . . . 0.0 109.895 178.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.62 -17.68 69.21 Favored Glycine 0 C--O 1.238 0.379 0 N-CA-C 114.833 0.693 . . . . 0.0 114.833 179.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.3 t -110.5 -14.83 14.03 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 117.714 0.757 . . . . 0.0 110.402 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.496 ' HB3' HG23 ' A' ' 471' ' ' VAL . 2.4 mt -66.51 149.28 50.68 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.008 -0.433 . . . . 0.0 110.211 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.415 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.1 tt0 -78.76 84.4 4.83 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-O 122.324 1.059 . . . . 0.0 111.916 -178.783 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.504 HG21 HD22 ' A' ' 546' ' ' LEU . 17.5 m -106.93 76.9 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 CA-C-O 126.897 3.237 . . . . 0.0 106.514 176.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.3 t -88.46 171.59 9.99 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 110.235 -3.166 . . . . 0.0 103.677 172.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.26 -34.61 15.6 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.49 -41.51 73.13 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.415 HD13 ' O ' ' A' ' 507' ' ' GLN . 3.8 mp -88.74 -39.65 12.72 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.822 0 CA-C-O 122.483 1.135 . . . . 0.0 108.912 -178.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 31.1 mt -60.78 -39.65 89.65 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.139 -174.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -63.44 -34.82 78.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -89.95 -8.06 52.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.24 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -125.92 37.83 4.27 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.428 0.632 . . . . 0.0 110.711 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 3.6 p -61.1 -28.11 68.85 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -178.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.57 -30.46 71.57 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.426 0.631 . . . . 0.0 112.136 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.722 HG21 HD21 ' A' ' 475' ' ' LEU . 34.0 t -74.24 -42.94 50.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.7 t -61.94 -37.75 79.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.86 -37.76 88.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.734 177.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 95.6 m -71.23 -39.31 71.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.679 HD23 HD11 ' A' ' 526' ' ' ILE . 70.0 mt -59.67 -35.75 75.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.199 0.523 . . . . 0.0 110.362 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -65.2 -29.09 69.87 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.947 -0.471 . . . . 0.0 111.254 175.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -72.18 -45.62 59.65 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 122.098 -0.376 . . . . 0.0 111.349 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.679 HD11 HD23 ' A' ' 523' ' ' LEU . 17.1 pt -78.79 -18.1 13.3 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.864 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -176.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.468 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.79 -15.93 59.94 Favored 'General case' 0 C--O 1.212 -0.899 0 O-C-N 121.965 -0.459 . . . . 0.0 111.503 176.287 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -118.72 17.94 13.47 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 122.774 0.429 . . . . 0.0 111.241 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.41 ' CE2' ' HB3' ' A' ' 531' ' ' ALA . 14.7 t80 -63.02 123.65 19.11 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.667 0.387 . . . . 0.0 110.207 -178.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -92.4 -21.92 19.94 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 -175.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.41 ' HB3' ' CE2' ' A' ' 529' ' ' TYR . . . -65.89 -41.61 91.31 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.265 0.555 . . . . 0.0 110.589 -177.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -130.26 115.55 17.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.025 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.6 tptt -55.76 -47.95 76.13 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.222 177.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -54.99 -42.81 72.95 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -175.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.7 t -56.68 -45.08 82.57 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 O-C-N 122.016 -0.428 . . . . 0.0 109.887 177.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.4 ttp -65.04 -43.79 91.19 Favored 'General case' 0 CA--C 1.51 -0.59 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.56 -48.6 76.78 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . 0.401 ' HB3' HD23 ' A' ' 500' ' ' LEU . 44.0 tptt -71.0 -38.36 72.66 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.282 -178.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.52 -39.96 85.58 Favored 'General case' 0 CA--C 1.501 -0.926 0 CA-C-O 121.625 0.726 . . . . 0.0 109.044 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.468 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.89 -49.04 76.4 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.535 -1.211 . . . . 0.0 113.052 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.81 -41.35 91.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 51.2 t -70.45 -51.99 33.13 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.021 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.676 -177.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -54.59 -45.05 73.51 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.633 0.254 . . . . 0.0 110.317 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 20.5 m -65.93 -36.03 82.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.886 0.374 . . . . 0.0 111.248 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -59.37 -30.74 68.62 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.038 -0.413 . . . . 0.0 110.26 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.504 HD22 HG21 ' A' ' 508' ' ' VAL . 6.3 mt -76.63 -32.81 58.26 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 -176.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.71 -30.22 71.35 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.67 179.46 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 36.2 m . . . . . 0 C--N 1.316 -0.878 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.706 176.872 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.3 m . . . . . 0 C--O 1.225 -0.21 0 CA-C-O 121.054 0.454 . . . . 0.0 111.798 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.435 HG13 ' HB3' ' A' ' 506' ' ' LEU . 44.0 t -54.8 -46.9 75.04 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 179.478 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.412 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.9 OUTLIER -62.24 -34.35 76.34 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -178.454 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -67.91 -41.2 83.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.579 1.181 . . . . 0.0 108.184 179.698 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . 0.405 ' O ' HD22 ' A' ' 478' ' ' LEU . 58.2 mtpt -72.9 -35.31 67.06 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.569 -177.876 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.5 HD21 HG21 ' A' ' 519' ' ' VAL . 3.8 tt -57.92 -36.66 72.8 Favored 'General case' 0 C--O 1.211 -0.933 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.361 178.464 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -57.32 -42.42 81.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.835 0.743 . . . . 0.0 110.124 177.909 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -67.44 -54.33 21.23 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.645 178.118 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . 0.405 HD22 ' O ' ' A' ' 474' ' ' LYS . 0.1 OUTLIER -58.27 -44.85 88.62 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -178.465 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.426 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.6 t-160 -57.79 -44.5 86.31 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -179.89 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.2 m -62.84 -39.3 93.94 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.623 0.231 . . . . 0.0 111.623 -179.03 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.456 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 14.6 mm-40 -63.98 -37.53 87.77 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.396 178.507 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.4 mt -58.99 -43.53 89.08 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 178.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -64.01 -44.06 93.76 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 122.082 -0.386 . . . . 0.0 112.003 -178.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -65.83 -32.8 74.52 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.75 -178.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.89 -16.67 64.19 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 179.224 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 35.2 mt -110.51 12.21 22.91 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -177.224 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 50.0 mttt -55.26 132.65 48.32 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.255 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.9 t -64.17 -41.71 93.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 122.343 1.068 . . . . 0.0 108.484 176.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -68.14 -29.75 68.71 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 113.574 -1.648 . . . . 0.0 113.281 -178.417 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 10.8 t -160.69 75.99 2.65 Favored Pre-proline 0 N--CA 1.469 0.513 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -175.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.36 145.87 30.75 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 117.203 -1.398 . . . . 0.0 113.206 178.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -137.32 100.66 4.3 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.286 0.565 . . . . 0.0 111.092 178.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.441 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.5 OUTLIER -56.66 -45.36 82.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -179.341 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 10.9 pttt -59.33 -32.53 70.17 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 121.89 0.852 . . . . 0.0 109.605 -176.919 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -70.39 -40.8 73.73 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.417 -1.265 . . . . 0.0 108.816 -176.473 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.81 -48.5 71.5 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 175.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.8 mt -56.93 -43.39 81.44 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -176.724 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -65.42 -37.9 88.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.488 0.661 . . . . 0.0 111.745 179.608 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.456 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.33 -46.67 66.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.721 0.772 . . . . 0.0 109.682 178.363 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -49.39 72.75 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.396 178.938 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -61.46 -34.66 75.83 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -175.238 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -45.71 60.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 176.731 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.93 -33.51 68.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.465 0.65 . . . . 0.0 109.868 -178.691 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.93 -17.87 68.05 Favored Glycine 0 C--O 1.236 0.251 0 CA-C-O 119.206 -0.775 . . . . 0.0 114.852 179.423 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.7 t -112.53 -6.23 13.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.345 1.073 . . . . 0.0 110.894 -179.733 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.435 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.0 mt -72.49 150.16 43.5 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.05 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -78.84 84.46 4.89 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-O 122.671 1.224 . . . . 0.0 109.213 178.145 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.897 HG21 HD22 ' A' ' 546' ' ' LEU . 27.1 m -98.63 50.72 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-O 123.536 1.636 . . . . 0.0 109.115 -177.379 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 3.7 t -64.51 167.83 6.62 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 -179.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.7 m -49.25 -32.16 10.16 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -176.185 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -55.38 -44.7 76.31 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 178.28 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.0 mp -85.97 -43.46 16.46 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-O 121.961 0.886 . . . . 0.0 108.887 179.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.57 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.13 -39.91 79.91 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -175.182 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -72.7 -28.51 62.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.346 -176.767 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -88.99 -8.25 54.45 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.862 176.709 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -125.1 40.97 3.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.631 0.729 . . . . 0.0 111.735 -179.066 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 10.7 p -62.75 -24.48 67.72 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -179.103 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.62 -30.86 71.92 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.45 0.643 . . . . 0.0 112.037 177.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.5 HG21 HD21 ' A' ' 475' ' ' LEU . 22.6 t -71.87 -41.34 69.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.89 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . 0.418 HG21 HD13 ' A' ' 513' ' ' LEU . 29.9 t -63.22 -37.98 80.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.681 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.93 -32.59 74.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.653 177.737 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.4 m -79.49 -40.22 30.24 Favored 'General case' 0 C--O 1.217 -0.632 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.512 HD23 HD11 ' A' ' 526' ' ' ILE . 38.7 mt -57.61 -35.41 70.42 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.114 0.483 . . . . 0.0 111.039 178.57 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -63.97 -29.05 70.24 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.07 -0.394 . . . . 0.0 111.533 175.175 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -74.13 -45.42 48.98 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.272 -0.268 . . . . 0.0 111.547 178.655 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.512 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -77.53 -21.23 14.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.932 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 -176.427 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -61.56 -18.87 61.12 Favored 'General case' 0 C--O 1.211 -0.959 0 O-C-N 121.961 -0.462 . . . . 0.0 111.658 176.056 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.75 19.44 13.15 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.154 0.582 . . . . 0.0 111.965 177.15 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.435 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 10.1 t80 -59.97 123.32 16.72 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.136 0.493 . . . . 0.0 111.629 -177.805 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -81.79 -28.46 33.18 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -176.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.435 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -69.17 -38.81 78.9 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -174.721 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -135.05 121.38 20.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.768 0.318 . . . . 0.0 110.765 -177.937 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.7 tptt -64.17 -40.32 95.87 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 178.221 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -46.97 73.88 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 123.341 0.656 . . . . 0.0 111.467 -176.525 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.0 t -58.73 -44.75 90.74 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.904 178.331 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -62.11 -44.2 97.16 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.97 -47.45 77.53 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.419 -0.512 . . . . 0.0 112.229 179.814 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -70.18 -38.21 75.34 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 118.408 -1.317 . . . . 0.0 111.285 -178.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.4 -39.73 84.34 Favored 'General case' 0 C--O 1.213 -0.832 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.365 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.421 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.91 -48.93 72.4 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.813 -1.085 . . . . 0.0 113.036 178.756 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -41.62 89.55 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.84 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.9 t -70.52 -50.33 46.08 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.013 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.937 -178.276 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -55.49 -44.74 76.81 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 -178.211 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.1 m -66.63 -35.57 80.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.263 0.554 . . . . 0.0 111.131 179.184 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 15.5 mtt85 -61.2 -29.43 69.81 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.879 -0.513 . . . . 0.0 109.99 175.217 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.897 HD22 HG21 ' A' ' 508' ' ' VAL . 8.8 mt -76.6 -36.03 57.76 Favored 'General case' 0 C--O 1.205 -1.268 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -177.555 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -30.1 70.24 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.588 178.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.4 m . . . . . 0 C--N 1.318 -0.801 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.108 178.483 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.4 m . . . . . 0 C--O 1.225 -0.186 0 CA-C-O 121.027 0.441 . . . . 0.0 111.86 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.441 HG13 HD23 ' A' ' 506' ' ' LEU . 45.0 t -56.09 -47.93 79.74 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.929 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -179.749 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.4 OUTLIER -64.94 -34.26 78.0 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -178.57 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -66.49 -43.59 84.98 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.024 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 19.7 mttt -69.37 -33.75 73.53 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.368 -178.02 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -56.71 -38.88 72.93 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.607 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.98 -40.22 69.84 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.992 -178.862 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -67.02 -55.06 16.0 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 176.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -46.14 90.63 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -176.712 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -61.45 -39.5 91.05 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.644 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 65.2 m -65.11 -41.17 95.17 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.556 179.164 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.13 -42.64 99.56 Favored 'General case' 0 CA--C 1.501 -0.934 0 C-N-CA 120.976 -0.289 . . . . 0.0 111.19 178.388 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -54.65 -46.64 73.16 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.269 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.683 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 43.6 mtpt -67.81 -38.85 83.81 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -177.425 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -67.32 -32.92 74.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.895 0.379 . . . . 0.0 110.198 178.099 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.0 -19.68 66.12 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 178.955 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 25.4 mt -105.22 12.16 32.21 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.386 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 29.4 mtpt -55.66 130.38 42.92 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.564 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 44.9 t -63.6 -40.51 89.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 122.395 1.093 . . . . 0.0 108.931 177.992 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -30.44 71.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.568 -1.651 . . . . 0.0 113.016 -178.24 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 2.7 p -163.08 79.66 1.68 Allowed Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.343 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.04 146.28 51.9 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 116.938 -1.575 . . . . 0.0 112.265 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -137.22 92.65 2.73 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.513 0.673 . . . . 0.0 109.921 -175.714 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.418 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.9 OUTLIER -58.9 -45.0 92.06 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.798 0 N-CA-C 113.391 0.885 . . . . 0.0 113.391 -177.229 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -57.12 -31.9 65.78 Favored 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -178.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -71.03 -41.47 70.81 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.675 -177.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.474 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -63.92 -48.61 75.9 Favored 'General case' 0 C--O 1.211 -0.942 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 176.7 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 81.2 mt -57.99 -44.19 87.01 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 117.863 0.301 . . . . 0.0 111.619 -176.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.16 -39.07 91.4 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.622 0.725 . . . . 0.0 110.735 178.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.82 -49.33 62.83 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.357 0.598 . . . . 0.0 109.796 178.816 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.474 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.06 -45.43 83.24 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.52 178.282 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -65.35 -33.31 75.66 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 121.243 -0.91 . . . . 0.0 112.504 -176.848 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -67.8 -49.37 62.71 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 105.307 -2.108 . . . . 0.0 105.307 175.395 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -30.63 33.53 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.54 0.686 . . . . 0.0 111.119 -177.64 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -62.97 -28.36 71.88 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 114.894 0.718 . . . . 0.0 114.894 178.163 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 8.0 t -100.86 -26.36 13.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 117.745 0.773 . . . . 0.0 110.808 -179.342 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.441 HD23 HG13 ' A' ' 471' ' ' VAL . 3.0 mp -55.46 136.01 50.04 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 176.362 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -78.81 84.37 4.87 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-O 122.975 1.369 . . . . 0.0 110.416 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.919 HG21 HD22 ' A' ' 546' ' ' LEU . 27.4 m -95.7 48.5 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.325 0 CA-C-O 122.963 1.363 . . . . 0.0 108.734 -178.988 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 8.9 t -66.92 171.64 5.21 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 -178.219 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.23 -30.74 7.52 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -174.369 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -55.48 -46.55 76.87 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.391 -0.193 . . . . 0.0 111.519 177.052 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -87.12 -41.05 14.42 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 CA-C-O 121.511 0.672 . . . . 0.0 109.695 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.507 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.7 -36.18 76.0 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -174.894 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -65.4 -32.27 73.81 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.755 0.788 . . . . 0.0 111.722 -178.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -95.76 -0.33 51.49 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.801 -179.229 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -133.01 42.59 3.04 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.568 0.699 . . . . 0.0 111.613 179.175 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.2 p -64.14 -27.21 68.93 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -179.122 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -65.04 -24.43 67.48 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.654 0.74 . . . . 0.0 111.938 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 55.4 t -70.55 -43.53 77.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 179.173 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 28.8 t -64.21 -36.17 76.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.238 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.26 -38.27 88.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.813 177.325 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.4 m -76.08 -38.6 56.84 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 118.874 0.761 . . . . 0.0 109.861 -179.551 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.587 HD23 HD11 ' A' ' 526' ' ' ILE . 49.5 mt -58.15 -35.19 71.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.02 0.438 . . . . 0.0 111.226 178.639 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -64.46 -29.18 70.23 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.993 -0.442 . . . . 0.0 111.465 175.129 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -73.04 -46.31 52.54 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 117.767 0.258 . . . . 0.0 111.423 178.845 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.587 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -77.21 -20.52 14.3 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -176.106 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.419 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -62.44 -15.82 51.63 Favored 'General case' 0 C--O 1.212 -0.885 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 177.259 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 11.6 ptp85 -118.69 19.34 13.23 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.031 0.533 . . . . 0.0 111.458 175.891 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -64.07 105.69 0.92 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -175.72 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -70.09 -30.14 67.29 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -176.703 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.74 -27.5 66.85 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -174.637 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -147.69 113.74 5.82 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.096 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 41.8 tptt -56.71 -45.46 81.87 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.531 -178.294 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -56.48 -40.68 75.32 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.987 0.422 . . . . 0.0 112.003 -175.836 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -56.84 -45.1 83.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 177.384 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -64.84 -43.41 93.14 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 119.192 -0.432 . . . . 0.0 110.241 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.48 -48.17 76.2 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.409 -0.517 . . . . 0.0 112.005 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 31.4 tptt -68.62 -39.48 80.78 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.071 -178.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.63 -40.82 84.46 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-O 121.306 0.574 . . . . 0.0 109.518 177.827 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.419 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.5 -48.27 75.78 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.247 -0.888 . . . . 0.0 113.296 179.433 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -42.24 93.67 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.1 t -70.65 -50.09 47.09 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.8 -178.579 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -54.79 -45.46 74.33 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.733 0.301 . . . . 0.0 110.193 -177.351 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.6 m -66.82 -33.97 76.77 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.397 0.617 . . . . 0.0 111.312 179.916 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 13.1 mtt85 -61.35 -29.81 70.13 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 121.796 -0.565 . . . . 0.0 109.96 174.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.919 HD22 HG21 ' A' ' 508' ' ' VAL . 9.0 mt -76.52 -34.01 58.58 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -175.208 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -27.87 69.63 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.961 178.08 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.7 m . . . . . 0 C--N 1.316 -0.891 0 CA-C-N 114.607 -1.179 . . . . 0.0 112.075 177.505 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.8 m . . . . . 0 C--O 1.22 -0.456 0 CA-C-O 121.006 0.431 . . . . 0.0 111.777 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.403 HG13 HD23 ' A' ' 506' ' ' LEU . 56.0 t -54.61 -47.18 72.71 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.792 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.681 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -65.07 -33.78 76.86 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -178.53 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.11 -41.74 85.72 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.97 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -72.43 -32.73 66.55 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.863 -177.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -57.42 -39.17 75.64 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.306 -179.541 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -53.76 -38.84 64.82 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.969 -178.878 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -70.42 -55.38 9.19 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.444 176.424 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.9 -45.89 82.31 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -176.397 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 17.9 t-160 -62.02 -38.79 90.0 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.477 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 52.0 m -65.39 -41.31 93.81 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.357 178.696 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 7.1 mm-40 -63.81 -42.41 97.68 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 117.938 0.336 . . . . 0.0 111.255 178.742 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.52 -46.74 71.73 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 177.329 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 50.1 mtpt -68.14 -38.63 82.39 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.163 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -66.58 -32.68 74.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 177.934 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.78 -19.41 65.88 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 178.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 21.6 mt -104.11 12.1 34.36 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -56.47 129.44 40.73 Favored 'General case' 0 C--O 1.208 -1.114 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 178.126 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 57.0 t -62.41 -39.84 85.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 122.44 1.114 . . . . 0.0 108.242 177.229 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.36 -28.75 69.5 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 113.272 -1.786 . . . . 0.0 113.165 -179.506 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 95.9 p -163.03 76.68 1.87 Allowed Pre-proline 0 C--O 1.241 0.627 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.017 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.82 144.97 49.78 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 114.701 -3.066 . . . . 0.0 111.895 179.469 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -137.21 91.53 2.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.755 0.788 . . . . 0.0 110.228 -174.851 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.414 HG12 ' H ' ' A' ' 493' ' ' VAL . 1.0 OUTLIER -57.29 -45.65 85.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -177.636 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.72 -30.47 68.84 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -178.0 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -71.01 -41.64 70.65 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -178.501 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.476 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.23 -48.31 76.32 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.458 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 94.0 mt -57.64 -42.55 83.65 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 117.627 0.194 . . . . 0.0 111.464 -177.343 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -64.8 -39.1 93.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.3 0.572 . . . . 0.0 111.25 178.382 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -65.82 -48.67 70.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 177.995 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.476 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -58.53 -44.57 89.62 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.505 178.822 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.27 -33.18 75.22 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 119.086 0.857 . . . . 0.0 111.544 -177.085 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -50.85 37.52 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 106.074 -1.825 . . . . 0.0 106.074 175.065 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.27 -30.72 18.74 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.211 0.529 . . . . 0.0 112.308 -177.479 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.64 -28.03 73.21 Favored Glycine 0 C--O 1.24 0.501 0 N-CA-C 114.91 0.724 . . . . 0.0 114.91 177.608 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 9.0 t -100.36 -25.94 14.05 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.322 0.561 . . . . 0.0 110.67 -177.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.403 HD23 HG13 ' A' ' 471' ' ' VAL . 3.0 mp -56.11 137.11 52.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 O-C-N 121.789 -0.569 . . . . 0.0 112.389 174.825 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.449 ' O ' HD13 ' A' ' 512' ' ' ILE . 30.3 tt0 -78.97 80.23 5.33 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 122.588 1.185 . . . . 0.0 109.795 -179.422 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.817 HG21 HD22 ' A' ' 546' ' ' LEU . 30.9 m -93.33 49.76 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 CA-C-O 123.248 1.499 . . . . 0.0 108.081 -179.731 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.6 t -66.96 174.95 2.72 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 113.859 -1.518 . . . . 0.0 107.122 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 21.0 m -49.29 -36.16 20.05 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -173.577 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -53.72 -44.54 69.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 178.42 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.449 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -88.57 -40.29 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 -179.33 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.436 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.71 -39.81 81.89 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -176.261 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -68.89 -31.09 69.76 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.757 -0.202 . . . . 0.0 111.358 -178.375 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -90.04 -2.38 58.11 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 122.235 -0.291 . . . . 0.0 111.328 177.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -129.91 46.51 2.64 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.698 0.761 . . . . 0.0 111.802 179.046 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.2 p -64.6 -28.83 69.89 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 121.713 -0.617 . . . . 0.0 112.307 -179.29 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -65.41 -28.56 69.34 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.393 0.616 . . . . 0.0 111.715 177.851 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 59.5 t -68.9 -44.52 81.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.782 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 34.4 t -62.56 -36.36 74.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.211 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.6 -40.1 95.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 119.345 -0.36 . . . . 0.0 110.7 177.309 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 93.6 m -72.77 -39.71 66.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 118.704 0.684 . . . . 0.0 110.532 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.665 HD23 HD11 ' A' ' 526' ' ' ILE . 68.9 mt -57.76 -35.02 70.19 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.903 0.382 . . . . 0.0 111.133 178.828 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -65.41 -29.05 69.71 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.691 -0.631 . . . . 0.0 111.527 175.928 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -73.05 -46.03 54.09 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.022 0.439 . . . . 0.0 110.798 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.665 HD11 HD23 ' A' ' 523' ' ' LEU . 15.2 pt -77.39 -21.44 14.19 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 -175.843 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.469 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -62.49 -18.86 62.81 Favored 'General case' 0 C--O 1.212 -0.888 0 O-C-N 121.94 -0.475 . . . . 0.0 111.422 175.89 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.77 18.98 13.27 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 122.846 0.458 . . . . 0.0 111.101 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -63.04 119.95 10.47 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 122.612 0.365 . . . . 0.0 110.69 -178.479 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -88.45 -23.29 23.31 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 115.437 1.643 . . . . 0.0 115.437 -175.598 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.01 -41.22 91.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.245 0.545 . . . . 0.0 110.993 -177.641 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -130.8 112.64 13.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.91 -179.048 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -56.78 -43.65 81.06 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.889 179.086 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -55.79 -41.86 74.72 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -176.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.2 t -58.19 -43.33 85.45 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.092 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -64.17 -44.03 93.32 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 179.786 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -63.56 -48.91 75.52 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.958 -179.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -70.54 -39.04 74.23 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 118.717 -1.193 . . . . 0.0 111.132 -177.516 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.43 -39.56 83.93 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 121.355 0.598 . . . . 0.0 109.789 178.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.58 -46.2 83.74 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.28 -0.873 . . . . 0.0 113.172 178.745 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -40.42 90.67 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.006 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 55.6 t -70.68 -53.62 21.45 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.359 -178.793 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -53.94 -44.94 71.09 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 122.293 0.237 . . . . 0.0 110.734 -175.027 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 28.0 m -64.2 -38.79 92.33 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 123.203 0.601 . . . . 0.0 111.125 179.136 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 40.6 mtt85 -61.91 -30.65 71.04 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 121.748 -0.595 . . . . 0.0 110.909 176.923 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.817 HD22 HG21 ' A' ' 508' ' ' VAL . 5.8 mt -75.6 -31.73 60.05 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 -177.149 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -36.57 78.72 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.974 176.014 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.4 m . . . . . 0 CA--C 1.539 0.534 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 177.02 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.6 m . . . . . 0 N--CA 1.461 0.121 0 CA-C-O 121.088 0.471 . . . . 0.0 111.478 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.407 HG13 ' HB3' ' A' ' 506' ' ' LEU . 45.2 t -55.43 -46.17 78.53 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.047 0 O-C-N 122.212 -0.305 . . . . 0.0 111.543 179.095 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.418 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -64.69 -35.25 80.43 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -177.529 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.56 -42.08 87.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.84 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -69.22 -38.12 78.38 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 121.546 0.688 . . . . 0.0 109.503 -179.154 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.613 HD21 HG21 ' A' ' 519' ' ' VAL . 4.5 tt -57.73 -35.58 70.88 Favored 'General case' 0 C--O 1.209 -1.045 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.727 179.424 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -57.58 -41.31 80.89 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 119.366 0.984 . . . . 0.0 110.402 178.066 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -67.39 -53.22 31.19 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.721 178.427 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -45.22 88.81 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.892 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.464 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.0 t-160 -58.17 -44.8 88.15 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -179.846 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.1 m -62.69 -39.07 92.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 -179.125 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.415 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 13.3 mm-40 -64.11 -37.62 88.12 Favored 'General case' 0 CA--C 1.505 -0.764 0 C-N-CA 120.516 -0.473 . . . . 0.0 110.49 178.346 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.4 mt -59.09 -43.39 89.1 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.954 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 178.845 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -63.04 -45.32 92.81 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 122.127 -0.358 . . . . 0.0 111.855 -179.485 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -65.71 -33.24 75.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.734 0.302 . . . . 0.0 111.121 -178.524 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.15 -15.99 64.05 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 179.37 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 36.0 mt -111.87 12.1 20.82 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -177.914 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt -54.23 129.48 35.22 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 177.434 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.39 -40.33 83.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 122.73 1.253 . . . . 0.0 107.893 177.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.84 -24.63 64.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 112.959 -1.928 . . . . 0.0 113.348 179.944 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 7.1 m -159.58 71.74 3.3 Favored Pre-proline 0 N--CA 1.475 0.788 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -176.778 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -71.49 139.82 35.2 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 114.142 -3.438 . . . . 0.0 112.006 179.144 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -137.14 95.85 3.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.529 0.681 . . . . 0.0 111.583 -177.649 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.409 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.5 OUTLIER -55.12 -48.88 75.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -176.871 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 19.8 pttm -58.61 -32.55 69.11 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-O 122.533 1.159 . . . . 0.0 110.503 -175.566 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -67.86 -42.17 81.75 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.194 -178.144 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.4 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.8 -48.34 74.79 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.733 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 75.5 mt -56.76 -43.19 80.55 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -176.125 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -64.64 -38.77 92.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.639 0.733 . . . . 0.0 111.95 179.384 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.85 -44.87 69.0 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.468 0.652 . . . . 0.0 109.551 179.333 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.4 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.05 -49.8 72.73 Favored 'General case' 0 N--CA 1.428 -1.564 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.463 177.224 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -62.4 -34.86 77.56 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -175.376 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -67.8 -48.22 66.88 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 176.367 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -32.21 66.46 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.291 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.6 -15.66 66.64 Favored Glycine 0 N--CA 1.453 -0.222 0 CA-C-O 119.104 -0.831 . . . . 0.0 114.382 179.129 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.5 t -114.54 -13.72 12.16 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.482 1.141 . . . . 0.0 110.968 179.518 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.407 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.0 mt -67.29 148.25 51.93 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.818 -0.551 . . . . 0.0 110.558 179.472 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -77.83 84.41 4.14 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 122.738 1.256 . . . . 0.0 109.936 178.261 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.911 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -98.35 50.11 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-O 123.228 1.489 . . . . 0.0 109.138 -177.597 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.1 t -68.58 171.89 6.97 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 106.567 -1.642 . . . . 0.0 106.567 -179.195 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.28 -33.49 13.14 Favored 'General case' 0 C--O 1.218 -0.596 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -174.109 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -54.19 -44.39 71.51 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 111.441 0.163 . . . . 0.0 111.441 178.378 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.5 mp -88.52 -43.13 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-O 121.337 0.589 . . . . 0.0 110.088 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.526 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.9 -40.37 84.26 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -175.527 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -71.14 -28.64 64.43 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.136 -176.35 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -89.76 -5.55 56.85 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 122.332 -0.23 . . . . 0.0 111.169 176.903 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -127.44 42.55 3.3 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.854 0.835 . . . . 0.0 112.505 179.93 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 17.8 p -63.86 -24.01 67.58 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -179.264 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.54 -32.27 73.85 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.314 1.054 . . . . 0.0 112.213 178.293 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.613 HG21 HD21 ' A' ' 475' ' ' LEU . 61.3 t -69.6 -42.58 80.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 179.118 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 48.5 t -63.2 -37.47 79.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.079 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.41 -33.13 74.88 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.655 178.029 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.7 m -79.29 -39.38 33.08 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.904 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.526 HD23 HD11 ' A' ' 526' ' ' ILE . 40.7 mt -57.43 -34.7 69.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.985 0.421 . . . . 0.0 111.431 178.22 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -63.87 -29.2 70.41 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.781 -0.574 . . . . 0.0 111.568 175.157 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -74.77 -43.34 55.33 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.603 0.239 . . . . 0.0 111.611 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.526 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -78.78 -21.82 12.93 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.952 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -177.373 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.418 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -60.65 -17.91 50.3 Favored 'General case' 0 C--O 1.211 -0.924 0 O-C-N 122.032 -0.417 . . . . 0.0 112.091 176.357 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -118.71 19.35 13.21 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.053 0.541 . . . . 0.0 111.269 178.005 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -65.7 115.34 5.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.167 0.508 . . . . 0.0 111.46 -176.968 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -82.91 -23.6 33.46 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 -176.488 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.54 -40.33 92.78 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.972 -177.093 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -133.22 113.23 12.43 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.87 -178.773 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.1 tptt -56.05 -44.66 79.06 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.565 178.728 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -55.32 -43.15 74.65 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -176.731 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 76.0 t -57.91 -43.93 85.56 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 177.477 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -62.97 -44.69 95.36 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 119.333 -0.365 . . . . 0.0 110.04 179.414 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.91 -47.51 77.5 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.5 tptt -69.33 -39.24 78.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.115 -1.034 . . . . 0.0 111.28 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.92 85.94 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.263 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.418 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.73 -48.82 75.47 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.774 -1.103 . . . . 0.0 113.142 178.863 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -43.32 92.6 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.841 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 78.8 t -68.94 -50.55 53.06 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.877 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.162 -178.416 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -55.03 -43.86 74.09 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.611 0.243 . . . . 0.0 110.446 -177.692 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 16.5 m -67.57 -35.82 79.74 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 122.641 0.377 . . . . 0.0 111.123 179.265 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.52 -31.85 69.77 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 176.182 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.911 HD22 HG21 ' A' ' 508' ' ' VAL . 5.5 mt -75.08 -36.73 61.72 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -176.327 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -56.45 -37.68 70.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.629 179.429 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 13.8 m . . . . . 0 C--N 1.322 -0.598 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 178.421 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.4 m . . . . . 0 C--O 1.224 -0.263 0 CA-C-O 120.998 0.427 . . . . 0.0 111.784 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . 0.427 HG13 ' HB3' ' A' ' 506' ' ' LEU . 32.7 t -53.89 -47.6 63.92 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 O-C-N 122.007 -0.433 . . . . 0.0 111.97 179.399 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -62.31 -33.68 75.13 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.428 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -67.28 -40.8 86.16 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -179.565 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -74.21 -35.58 63.92 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.409 -178.034 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.622 HD21 HG21 ' A' ' 519' ' ' VAL . 3.7 tt -58.63 -37.2 75.39 Favored 'General case' 0 C--O 1.206 -1.197 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.237 178.369 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -59.07 -40.85 86.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 119.036 0.835 . . . . 0.0 110.61 178.422 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -64.82 -53.13 51.7 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.789 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -44.57 93.89 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.079 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.424 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.4 t-160 -57.9 -44.79 86.99 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -178.898 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.7 m -62.77 -39.63 94.8 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.181 0.301 . . . . 0.0 111.622 -179.325 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -64.41 -37.25 86.86 Favored 'General case' 0 CA--C 1.504 -0.81 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.625 178.337 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.8 mt -59.14 -43.47 89.48 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.031 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 178.872 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.7 mmtt -63.68 -46.02 87.43 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.37 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -64.81 -33.04 75.05 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 120.8 0.333 . . . . 0.0 111.16 -178.246 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.59 -17.55 64.67 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 179.958 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.2 mt -111.89 12.05 20.8 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -177.091 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -66.76 133.38 50.02 Favored 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 179.932 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 40.4 t -56.89 -39.14 63.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-O 122.079 0.942 . . . . 0.0 111.326 -177.246 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -63.02 -30.24 71.44 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 113.978 -1.465 . . . . 0.0 113.381 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 2.2 m -164.53 78.62 1.43 Allowed Pre-proline 0 N--CA 1.479 0.986 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.399 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.96 147.52 61.75 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 115.732 -2.379 . . . . 0.0 112.339 177.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -137.3 99.57 4.01 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.672 0.748 . . . . 0.0 110.118 -179.386 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.22 -47.26 84.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.355 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.94 -32.62 67.97 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 121.99 0.9 . . . . 0.0 109.989 -176.74 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -69.52 -41.37 76.09 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.268 -1.333 . . . . 0.0 108.933 -176.543 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.405 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.57 -49.81 67.48 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 176.096 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 81.2 mt -56.45 -43.07 79.16 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.286 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.35 -38.27 90.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.64 0.733 . . . . 0.0 112.07 -179.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -72.1 -44.81 62.64 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.722 -0.612 . . . . 0.0 109.642 178.449 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.405 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.59 -48.09 72.55 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.542 177.205 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -62.55 -35.76 80.48 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -176.17 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -67.84 -48.97 64.69 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.395 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.66 -33.63 64.25 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.88 -179.526 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.71 -17.77 69.49 Favored Glycine 0 C--O 1.236 0.276 0 N-CA-C 115.165 0.826 . . . . 0.0 115.165 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.9 t -111.08 -12.77 14.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.064 0.932 . . . . 0.0 110.484 -179.584 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . 0.427 ' HB3' HG13 ' A' ' 471' ' ' VAL . 5.2 mt -67.71 148.15 51.69 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.979 -0.451 . . . . 0.0 110.462 -179.884 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.417 ' O ' HD13 ' A' ' 512' ' ' ILE . 37.4 tt0 -78.59 84.46 4.71 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-O 122.841 1.305 . . . . 0.0 109.078 177.655 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.876 HG21 HD22 ' A' ' 546' ' ' LEU . 30.3 m -99.97 48.37 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 CA-C-O 123.087 1.422 . . . . 0.0 108.477 -177.875 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.4 t -67.06 172.45 4.55 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 -179.602 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 24.1 m -49.23 -32.19 10.14 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -174.419 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -54.48 -44.95 73.08 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 178.169 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.417 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -88.68 -42.6 14.79 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 CA-C-O 121.261 0.553 . . . . 0.0 109.656 179.388 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.523 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.85 -40.07 83.16 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 -175.196 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -70.53 -28.95 65.33 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.192 -176.875 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -90.54 -4.25 57.03 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 122.364 -0.21 . . . . 0.0 111.171 177.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -128.24 43.02 3.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.674 0.75 . . . . 0.0 112.361 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.7 p -63.44 -24.34 67.79 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -178.833 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.64 -30.61 71.34 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.527 0.679 . . . . 0.0 112.158 178.077 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.622 HG21 HD21 ' A' ' 475' ' ' LEU . 42.7 t -71.18 -41.55 75.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 107.262 -1.385 . . . . 0.0 107.262 178.402 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 38.1 t -62.99 -37.67 79.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.616 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.08 -34.52 78.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.447 177.7 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.7 m -77.1 -39.76 48.39 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.668 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.54 HD23 HD11 ' A' ' 526' ' ' ILE . 47.0 mt -58.36 -35.52 72.08 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.261 0.553 . . . . 0.0 110.933 178.87 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.56 -29.08 70.1 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.998 -0.439 . . . . 0.0 111.343 175.246 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -72.91 -45.33 58.73 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 117.839 0.29 . . . . 0.0 111.472 178.391 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.54 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -77.66 -21.68 13.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -176.215 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.424 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.2 OUTLIER -61.19 -18.32 57.65 Favored 'General case' 0 C--O 1.211 -0.958 0 O-C-N 122.132 -0.355 . . . . 0.0 111.895 176.452 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -118.74 19.45 13.16 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.025 0.53 . . . . 0.0 112.042 176.537 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.405 ' CE2' ' HB3' ' A' ' 531' ' ' ALA . 11.2 t80 -60.96 118.18 6.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.236 0.541 . . . . 0.0 112.24 -177.263 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -74.04 -33.18 63.64 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 -176.672 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.405 ' HB3' ' CE2' ' A' ' 529' ' ' TYR . . . -67.01 -41.9 85.86 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -172.975 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -131.91 117.2 18.16 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 122.314 -0.241 . . . . 0.0 110.867 -177.811 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.4 tptt -57.7 -46.63 84.08 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.517 178.165 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -55.64 -42.66 75.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -176.383 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 72.2 t -56.73 -44.47 81.6 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.521 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 177.242 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.9 ttp -64.29 -43.86 93.45 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 119.151 -0.452 . . . . 0.0 110.036 179.435 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -64.7 -47.32 78.78 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.377 -0.529 . . . . 0.0 112.092 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -69.65 -39.14 77.25 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 119.148 -1.021 . . . . 0.0 111.104 -179.138 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.1 -39.92 83.71 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.414 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.88 -49.54 70.08 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.922 -1.036 . . . . 0.0 113.18 179.081 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -42.6 91.25 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.983 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.8 t -70.6 -50.09 47.42 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.464 -177.93 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -55.35 -45.11 76.46 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -177.999 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.6 m -66.75 -34.77 78.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.399 0.618 . . . . 0.0 111.186 179.55 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 12.3 mtt85 -60.71 -29.77 69.54 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.864 -0.522 . . . . 0.0 109.967 175.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.876 HD22 HG21 ' A' ' 508' ' ' VAL . 8.8 mt -76.52 -35.3 58.39 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -176.134 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.81 -28.93 70.34 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.03 178.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 22.1 m . . . . . 0 C--N 1.317 -0.835 0 CA-C-N 114.718 -1.128 . . . . 0.0 111.905 178.385 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.5 m . . . . . 0 C--O 1.225 -0.231 0 CA-C-O 120.989 0.423 . . . . 0.0 111.263 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 56.7 t -57.37 -46.41 85.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.022 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.432 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.414 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.3 pt-20 -65.49 -34.16 77.63 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.572 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -65.24 -42.86 92.92 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 177.393 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -70.05 -34.61 73.45 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.041 -179.201 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -57.55 -40.43 78.88 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.356 -178.552 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -55.01 -40.09 69.77 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.579 -179.213 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 53.3 tttt -67.94 -57.77 5.64 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.503 -0.184 . . . . 0.0 110.503 176.744 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -45.52 89.02 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -176.126 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -60.0 -42.28 93.92 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -179.325 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 61.8 m -62.64 -39.67 94.6 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.998 -179.218 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.415 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.6 mm-40 -63.72 -37.85 88.89 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.077 178.431 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -60.08 -42.53 90.24 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.022 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.368 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -64.81 -45.12 87.6 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 122.182 -0.324 . . . . 0.0 111.568 -179.452 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -66.2 -30.44 70.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.192 -178.185 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.73 -18.19 64.81 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 178.604 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 35.2 mt -107.66 12.21 27.76 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -177.985 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -55.23 135.87 49.25 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-O 121.697 0.761 . . . . 0.0 109.914 178.124 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 13.0 m -73.49 -21.45 18.63 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.149 178.877 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.58 -31.18 47.11 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 113.798 -1.546 . . . . 0.0 111.251 -178.873 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 43.5 t -168.8 83.41 0.69 Allowed Pre-proline 0 C--O 1.238 0.483 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.912 -175.831 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.35 146.45 50.66 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 115.447 -2.569 . . . . 0.0 111.964 178.014 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -137.18 100.12 4.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.857 0.837 . . . . 0.0 111.419 -178.839 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.443 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.6 OUTLIER -58.85 -44.2 90.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.959 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -60.65 -31.82 71.02 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -177.849 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -71.53 -41.81 68.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.1 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.435 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -63.94 -48.61 75.83 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.407 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 71.4 mt -56.87 -43.88 81.66 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -176.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -65.35 -38.72 90.95 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.322 0.582 . . . . 0.0 111.326 -179.658 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.24 -47.13 71.7 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.425 0.631 . . . . 0.0 109.463 178.631 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.435 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.09 -42.2 80.27 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.054 178.085 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -62.8 -37.93 88.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 119.094 0.861 . . . . 0.0 112.579 -177.942 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -70.93 -44.09 66.87 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.91 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -32.92 66.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.522 0.677 . . . . 0.0 110.738 179.164 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.53 -16.97 66.13 Favored Glycine 0 C--O 1.239 0.433 0 CA-C-O 119.165 -0.797 . . . . 0.0 114.749 -179.84 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.5 t -113.74 -15.37 12.46 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.15 0.975 . . . . 0.0 111.227 -179.766 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.0 mt -64.94 145.24 56.58 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.98 -0.45 . . . . 0.0 110.813 179.734 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.426 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.3 tt0 -79.62 84.29 5.49 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 122.531 1.158 . . . . 0.0 109.653 178.168 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.954 HG21 HD22 ' A' ' 546' ' ' LEU . 27.0 m -96.44 48.18 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-O 123.214 1.483 . . . . 0.0 108.21 -178.705 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.7 t -68.16 172.99 5.06 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 -178.296 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.6 m -49.29 -31.65 9.41 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -173.643 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -55.43 -44.59 76.44 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 177.015 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.426 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -88.66 -42.18 14.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.566 0 CA-C-O 121.72 0.772 . . . . 0.0 109.1 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.424 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -57.47 -40.5 78.71 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -175.591 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -69.71 -31.3 69.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.15 -177.455 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -89.29 -5.14 57.81 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.233 178.31 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -128.94 45.03 2.86 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.43 0.633 . . . . 0.0 112.19 -179.652 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 25.2 p -65.08 -26.76 68.37 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -179.375 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -63.39 -27.25 69.17 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.918 0.866 . . . . 0.0 111.992 177.799 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 55.0 t -70.65 -45.69 72.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 179.549 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.4 -36.99 78.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 179.052 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.4 -36.36 82.08 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.861 177.42 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 61.4 m -76.26 -40.54 51.63 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 118.182 0.446 . . . . 0.0 110.457 179.445 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.717 HD23 HD11 ' A' ' 526' ' ' ILE . 61.4 mt -57.97 -35.12 70.71 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.051 0.453 . . . . 0.0 111.087 178.85 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -63.86 -29.0 70.23 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.9 -0.5 . . . . 0.0 111.452 175.733 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -73.19 -46.46 50.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.787 0.327 . . . . 0.0 111.31 178.81 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.717 HD11 HD23 ' A' ' 523' ' ' LEU . 7.7 pt -77.12 -21.18 14.4 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -175.983 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.445 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.28 -14.7 52.52 Favored 'General case' 0 C--O 1.213 -0.842 0 O-C-N 121.746 -0.596 . . . . 0.0 112.282 175.786 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -118.86 17.78 13.37 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 122.48 0.312 . . . . 0.0 111.233 175.69 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . 0.418 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 10.1 t80 -62.88 126.16 26.4 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.957 0.408 . . . . 0.0 110.856 -177.071 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -92.43 -24.95 18.68 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -176.437 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . 0.418 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -64.82 -39.81 94.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.155 0.502 . . . . 0.0 110.965 -176.963 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -133.64 121.09 21.51 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.055 -179.405 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -60.26 -44.02 95.65 Favored 'General case' 0 C--O 1.211 -0.963 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.875 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.69 -43.98 76.92 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -175.401 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.6 t -58.39 -44.65 89.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.136 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.8 ttp -64.94 -43.29 93.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.106 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.43 -48.9 75.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 179.353 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 40.2 tptt -71.66 -37.72 70.76 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 118.493 -1.283 . . . . 0.0 111.19 -177.518 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . 0.425 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -58.2 -40.73 82.33 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-O 121.785 0.802 . . . . 0.0 108.952 178.363 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.445 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.75 -50.81 69.6 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.219 -1.355 . . . . 0.0 113.84 178.756 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.47 -43.67 89.01 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 -179.381 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.21 -52.62 41.01 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -177.134 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -53.98 -44.05 70.48 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.598 0.359 . . . . 0.0 110.551 -177.416 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 50.8 m -64.07 -38.52 91.37 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 123.844 0.858 . . . . 0.0 111.681 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -64.41 -28.5 69.72 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 121.552 -0.717 . . . . 0.0 110.781 176.734 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.954 HD22 HG21 ' A' ' 508' ' ' VAL . 7.2 mt -74.39 -35.62 63.49 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.027 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -57.72 -39.48 77.37 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.165 177.413 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 C--N 1.325 -0.477 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 178.947 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 7.1 m . . . . . 0 C--O 1.221 -0.441 0 CA-C-O 120.756 0.312 . . . . 0.0 111.26 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -54.79 -45.83 74.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 O-C-N 121.894 -0.504 . . . . 0.0 111.578 179.516 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.417 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.9 OUTLIER -62.48 -31.58 72.34 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.021 -178.854 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -73.5 -42.14 62.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 122.138 0.97 . . . . 0.0 108.405 179.384 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -70.33 -32.71 70.56 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.379 -177.628 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.415 ' C ' HD13 ' A' ' 475' ' ' LEU . 1.9 tm? -55.05 -40.21 70.04 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.358 178.842 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -54.23 -40.6 67.85 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.686 -178.268 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -69.54 -53.2 20.14 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.314 177.75 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -46.86 86.56 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -178.742 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -60.25 -43.67 95.91 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -179.465 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 69.0 m -60.24 -38.71 84.28 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 118.01 0.368 . . . . 0.0 111.124 -179.83 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -65.71 -36.34 83.34 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 120.159 -0.617 . . . . 0.0 110.978 177.549 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 89.1 mt -61.46 -43.12 96.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 178.696 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -62.18 -45.87 91.48 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 179.825 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -66.5 -34.23 77.45 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.747 0.308 . . . . 0.0 111.207 -178.368 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.35 -18.95 65.13 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 179.677 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.8 mt -108.2 12.15 26.86 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.573 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 8.5 mttm -56.82 131.6 49.87 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 176.869 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 14.5 m -72.7 -20.39 19.3 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.634 -179.329 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.7 -30.74 41.13 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 113.779 -1.555 . . . . 0.0 110.921 -178.951 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 25.0 t -166.27 85.8 0.92 Allowed Pre-proline 0 C--O 1.239 0.512 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.418 -177.977 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.81 149.56 48.21 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 117.314 -1.324 . . . . 0.0 112.415 178.477 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -137.29 93.39 2.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.589 0.709 . . . . 0.0 110.183 -177.246 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.417 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.8 OUTLIER -58.4 -47.34 88.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 -177.438 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 26.5 pttt -58.77 -31.4 68.34 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-O 121.696 0.76 . . . . 0.0 110.347 -176.38 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.0 ttm-85 -68.81 -43.33 75.81 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.227 -178.673 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.438 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -63.24 -48.81 76.68 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.556 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.9 mt -57.48 -42.79 83.34 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -176.762 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -65.53 -38.58 90.07 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.54 0.686 . . . . 0.0 111.495 179.163 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.69 -47.07 70.48 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.034 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.438 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.88 -45.58 82.46 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.206 178.859 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -64.75 -34.63 78.78 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -176.486 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -44.11 66.42 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 176.282 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.79 -35.6 66.47 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.28 0.562 . . . . 0.0 110.898 179.429 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.46 -18.65 69.97 Favored Glycine 0 C--O 1.239 0.448 0 N-CA-C 114.762 0.665 . . . . 0.0 114.762 -179.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 12.7 t -109.31 -12.4 14.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.917 0.858 . . . . 0.0 110.581 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -68.78 146.25 53.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.163 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -80.35 80.58 6.76 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-O 122.508 1.147 . . . . 0.0 109.031 178.144 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.881 HG21 HD22 ' A' ' 546' ' ' LEU . 29.3 m -94.3 48.17 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 123.071 1.415 . . . . 0.0 107.576 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.68 173.62 3.35 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.709 -177.978 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 34.3 m -48.46 -35.33 12.73 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.517 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -55.52 -44.34 76.58 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.267 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -87.62 -38.71 12.25 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.397 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -179.41 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.418 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.21 -37.74 81.2 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -176.749 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -66.27 -33.73 76.4 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.567 0.222 . . . . 0.0 111.426 -179.553 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -89.35 -3.29 58.52 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 121.076 -0.25 . . . . 0.0 111.316 179.172 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -128.12 43.42 3.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.875 0.845 . . . . 0.0 112.398 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -64.17 -28.56 69.84 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 121.722 -0.611 . . . . 0.0 112.466 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -70.53 -24.26 62.78 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.501 0.667 . . . . 0.0 112.034 179.176 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 86.7 t -70.87 -43.82 76.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 106.152 -1.796 . . . . 0.0 106.152 177.302 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 49.5 t -62.53 -35.62 70.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 178.244 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.99 -35.93 81.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 119.042 -0.504 . . . . 0.0 111.645 177.318 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.5 m -77.06 -39.17 50.87 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.165 0.893 . . . . 0.0 108.734 179.32 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.545 HD23 HD11 ' A' ' 526' ' ' ILE . 34.9 mt -57.5 -35.01 69.69 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.813 0.34 . . . . 0.0 111.664 179.019 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -63.3 -29.12 70.5 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.878 -0.513 . . . . 0.0 111.392 175.623 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -76.49 -46.24 27.6 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.657 0.265 . . . . 0.0 111.708 -179.422 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.545 HD11 HD23 ' A' ' 523' ' ' LEU . 1.1 pt -74.77 -23.57 17.78 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.932 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -176.929 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.455 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 1.7 mtm180 -59.94 -20.65 58.67 Favored 'General case' 0 C--O 1.214 -0.788 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 176.152 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -119.51 19.41 12.66 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.976 0.51 . . . . 0.0 111.48 178.854 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -62.03 117.91 6.59 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 121.063 0.458 . . . . 0.0 111.355 -177.564 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -79.49 -26.59 41.59 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -176.475 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.14 -40.93 86.84 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.692 -0.403 . . . . 0.0 112.081 -175.354 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -131.55 117.0 18.16 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -178.464 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -59.05 -43.62 91.7 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.617 179.039 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -57.79 -42.24 83.76 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.062 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -57.53 -43.12 82.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 O-C-N 121.809 -0.557 . . . . 0.0 109.542 177.454 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -43.03 94.36 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 178.559 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -63.87 -49.28 73.39 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.121 0.263 . . . . 0.0 110.476 -178.336 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -70.88 -40.63 72.13 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.958 -178.222 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.14 -38.77 80.47 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.14 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.455 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.79 -50.17 70.05 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 177.757 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.68 -42.15 83.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 77.0 t -70.44 -52.06 32.59 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.859 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.135 -178.618 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -54.48 -44.47 72.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.641 0.258 . . . . 0.0 110.412 -177.171 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 24.8 m -65.25 -38.43 90.33 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 122.909 0.483 . . . . 0.0 111.022 179.358 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 44.1 mtt180 -59.99 -30.71 69.31 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 121.838 -0.539 . . . . 0.0 110.752 176.573 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.881 HD22 HG21 ' A' ' 508' ' ' VAL . 3.8 mt -76.24 -30.88 58.08 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 -176.782 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.11 -37.95 89.23 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.899 177.575 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.7 m . . . . . 0 C--N 1.324 -0.538 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 177.982 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 15.0 m . . . . . 0 C--O 1.222 -0.389 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 22.4 t -53.0 -47.04 54.47 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.122 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 178.841 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.424 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.1 OUTLIER -63.74 -34.19 77.33 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.585 -177.252 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -68.76 -40.5 79.71 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 122.464 1.126 . . . . 0.0 108.526 179.42 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -73.34 -34.86 65.88 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.1 -177.731 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.571 HD21 HG21 ' A' ' 519' ' ' VAL . 4.5 tt -58.42 -36.14 73.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.054 179.408 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -54.18 -43.13 70.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 118.456 0.571 . . . . 0.0 109.862 178.325 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -67.82 -56.32 9.6 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.556 178.372 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -44.99 81.16 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.333 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . 0.441 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.4 t-160 -58.52 -43.56 89.21 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 179.166 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.5 m -64.74 -37.85 88.99 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 179.495 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.465 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.8 mm-40 -63.38 -38.14 90.01 Favored 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.05 178.307 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.11 -44.25 87.03 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.535 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.4 mmtt -62.52 -46.3 89.04 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -179.514 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -64.6 -33.59 76.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.871 0.367 . . . . 0.0 111.159 -178.243 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.84 -18.21 65.18 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 179.371 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . 0.409 HD11 ' CG2' ' A' ' 526' ' ' ILE . 26.1 mt -108.07 12.15 27.08 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.112 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -56.12 127.81 32.43 Favored 'General case' 0 CA--C 1.493 -1.219 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 176.527 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 29.6 m -70.25 -20.48 22.87 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.211 178.536 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -80.97 -27.41 36.0 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.155 -1.384 . . . . 0.0 111.091 177.864 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 4.2 m -160.81 75.62 2.63 Favored Pre-proline 0 N--CA 1.473 0.676 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -74.35 143.35 31.31 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 113.523 -3.851 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -137.25 98.19 3.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.788 0.804 . . . . 0.0 109.734 -178.65 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.44 -45.51 93.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.509 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -59.55 -31.05 69.06 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 -178.362 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -70.37 -41.29 73.3 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.762 -0.775 . . . . 0.0 108.96 -178.1 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.48 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.03 -48.35 76.66 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 175.889 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 96.7 mt -57.27 -43.18 82.87 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -176.719 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -64.58 -39.03 93.0 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.532 0.682 . . . . 0.0 111.3 178.677 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -65.74 -48.5 71.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.648 0.737 . . . . 0.0 109.695 178.599 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.48 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -57.86 -48.27 80.3 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.997 178.641 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -62.94 -33.07 74.57 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 119.847 -0.741 . . . . 0.0 112.803 -175.631 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.35 -48.65 40.18 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.44 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -30.67 42.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.801 0.81 . . . . 0.0 110.155 -178.849 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -63.85 -23.6 67.57 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 115.846 1.098 . . . . 0.0 115.846 176.821 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 9.0 t -104.88 -26.48 12.2 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 117.883 0.841 . . . . 0.0 110.367 178.766 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.2 mp -57.0 140.5 48.82 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 176.058 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -76.99 84.41 3.51 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 122.339 1.066 . . . . 0.0 110.692 -178.914 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.585 ' CG2' HD22 ' A' ' 546' ' ' LEU . 16.6 m -103.42 68.95 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 CA-C-O 126.794 3.188 . . . . 0.0 105.489 178.039 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.0 t -80.41 173.73 12.31 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 109.892 -3.322 . . . . 0.0 105.204 172.636 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.2 m -49.36 -36.73 22.4 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -175.365 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -54.29 -43.77 71.35 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -179.017 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.0 mp -88.56 -38.98 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.801 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 -178.03 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 4.8 mt -61.61 -39.4 91.12 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -175.886 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -68.82 -31.0 69.67 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.193 -0.203 . . . . 0.0 110.644 -177.861 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -87.27 -7.04 58.28 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 121.122 -0.231 . . . . 0.0 111.073 176.781 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -129.6 45.77 2.75 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.545 0.688 . . . . 0.0 112.11 179.194 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -63.89 -25.95 68.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.877 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.07 -29.03 69.3 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.846 0.831 . . . . 0.0 112.337 178.556 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . 0.571 HG21 HD21 ' A' ' 475' ' ' LEU . 65.0 t -71.08 -45.01 74.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 178.553 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 57.2 t -61.0 -38.1 78.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.149 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.25 -38.95 92.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.88 177.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 95.3 m -71.94 -38.69 69.79 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 118.371 0.532 . . . . 0.0 109.961 -178.613 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.634 HD23 HD11 ' A' ' 526' ' ' ILE . 63.3 mt -58.63 -34.89 71.69 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.116 0.484 . . . . 0.0 111.461 179.422 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -67.26 -29.13 68.67 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 121.613 -0.679 . . . . 0.0 111.012 176.27 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -71.52 -42.1 68.37 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.725 0.298 . . . . 0.0 111.151 179.861 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.634 HD11 HD23 ' A' ' 523' ' ' LEU . 6.0 pt -78.65 -23.28 13.12 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.266 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.539 ' HD2' ' HA ' ' A' ' 540' ' ' ALA . 7.4 mtp180 -64.69 -13.31 53.84 Favored 'General case' 0 C--O 1.217 -0.638 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 175.655 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.89 18.47 13.25 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.947 0.499 . . . . 0.0 111.544 175.07 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -66.47 118.07 9.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 112.044 -177.677 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -81.81 -26.64 34.18 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -177.573 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.54 -29.87 68.54 Favored 'General case' 0 C--O 1.219 -0.512 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -175.151 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -144.69 118.88 9.48 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.415 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -61.76 -46.58 88.95 Favored 'General case' 0 C--O 1.213 -0.86 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.452 -178.626 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -56.04 -38.96 71.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.17 0.509 . . . . 0.0 112.109 -175.175 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.8 t -55.96 -45.31 80.07 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 O-C-N 122.076 -0.39 . . . . 0.0 110.111 177.539 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -68.06 -40.78 82.69 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.754 178.432 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.09 -47.98 80.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 119.303 0.956 . . . . 0.0 111.567 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.7 tptt -72.18 -37.91 69.21 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 119.076 -1.049 . . . . 0.0 111.378 -178.741 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . 0.412 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -59.08 -38.06 78.56 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.254 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.539 ' HA ' ' HD2' ' A' ' 527' ' ' ARG . . . -66.63 -49.97 64.52 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.358 179.275 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -42.48 83.59 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.886 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 75.3 t -70.59 -53.45 22.37 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.262 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.965 -177.887 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 69.9 t80 -53.81 -46.97 71.26 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.184 0.516 . . . . 0.0 110.312 -176.011 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 27.8 m -60.07 -38.15 82.01 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.38 0.672 . . . . 0.0 112.343 178.286 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -65.21 -27.41 68.66 Favored 'General case' 0 C--N 1.32 -0.709 0 O-C-N 121.419 -0.801 . . . . 0.0 111.785 176.749 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.585 HD22 ' CG2' ' A' ' 508' ' ' VAL . 9.7 mt -75.59 -35.77 60.49 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -174.651 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -33.95 73.55 Favored 'General case' 0 C--O 1.205 -1.273 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.67 176.704 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 45.3 t . . . . . 0 C--N 1.319 -0.72 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.315 175.019 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.1 m . . . . . 0 C--O 1.224 -0.271 0 CA-C-O 121.109 0.481 . . . . 0.0 112.073 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.6 t -54.21 -44.19 63.64 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.38 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -66.92 -33.18 75.02 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 120.762 0.315 . . . . 0.0 111.721 -178.274 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.18 -39.98 82.38 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.675 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -73.72 -32.18 63.76 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.935 -177.242 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.426 HD23 HD21 ' A' ' 503' ' ' LEU . 1.6 tm? -54.58 -38.96 67.33 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.253 178.833 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -53.18 -38.71 63.06 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 121.321 -0.151 . . . . 0.0 111.264 -178.693 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -67.83 -57.67 5.89 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.568 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.88 -46.22 90.0 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -174.526 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -58.92 -43.16 91.08 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -179.501 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 67.0 m -63.28 -40.4 97.28 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 117.869 0.304 . . . . 0.0 111.213 -178.935 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.466 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.9 mm-40 -63.57 -37.52 87.65 Favored 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 120.671 -0.411 . . . . 0.0 111.149 178.862 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 94.3 mt -59.9 -44.06 93.52 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.989 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.168 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 49.2 mmtt -62.67 -44.67 95.66 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 122.153 -0.342 . . . . 0.0 111.919 -179.746 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -65.13 -33.88 77.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.781 0.324 . . . . 0.0 111.073 -178.189 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.89 -16.55 64.39 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 179.249 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 38.4 mt -111.08 12.24 21.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.868 -177.459 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -55.44 129.4 38.56 Favored 'General case' 0 C--O 1.21 -1.011 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 176.665 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.9 t -62.62 -39.75 85.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 122.16 0.981 . . . . 0.0 108.446 178.507 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.12 -28.07 64.04 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.066 -1.425 . . . . 0.0 113.414 -178.021 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.1 t -159.48 76.38 3.06 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -177.593 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -75.33 146.6 31.68 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 117.495 -1.203 . . . . 0.0 113.812 179.516 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -137.37 101.64 4.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.31 0.576 . . . . 0.0 111.397 178.575 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . 0.447 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.3 OUTLIER -56.58 -46.17 82.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -179.429 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 15.0 pttt -58.77 -32.2 69.06 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 121.857 0.837 . . . . 0.0 109.791 -176.478 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -70.83 -40.48 72.41 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.391 -1.277 . . . . 0.0 108.888 -176.476 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.437 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.51 -49.7 68.02 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 175.624 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.6 mt -56.91 -43.1 81.04 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.256 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -66.01 -37.08 84.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.467 0.651 . . . . 0.0 111.625 179.997 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.466 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.84 -47.71 68.21 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.772 0.796 . . . . 0.0 109.316 177.702 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.437 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.71 -44.97 82.07 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.77 178.632 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -60.57 -36.8 79.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 119.036 0.835 . . . . 0.0 112.673 -177.165 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -73.77 -42.64 60.74 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 178.69 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.426 HD21 HD23 ' A' ' 475' ' ' LEU . 0.5 OUTLIER -58.91 -34.29 71.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.164 0.507 . . . . 0.0 110.637 -179.436 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.1 -17.67 66.0 Favored Glycine 0 C--O 1.241 0.565 0 N-CA-C 114.848 0.699 . . . . 0.0 114.848 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.8 t -110.69 -14.7 13.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 117.699 0.75 . . . . 0.0 110.587 -179.131 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.2 mt -67.44 145.86 54.58 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.489 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.456 ' O ' HD13 ' A' ' 512' ' ' ILE . 30.3 tt0 -79.16 84.3 5.14 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 122.53 1.157 . . . . 0.0 109.797 178.37 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.947 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -96.8 48.5 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 CA-C-O 123.351 1.548 . . . . 0.0 108.126 -178.966 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.5 t -67.26 174.43 3.25 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 -179.436 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 13.1 m -49.23 -34.75 15.65 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -173.361 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -53.7 -44.06 69.47 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.73 0.271 . . . . 0.0 111.73 178.187 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.456 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.5 mp -88.48 -40.69 13.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.53 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.451 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.82 -38.04 80.89 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -175.644 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -66.99 -32.61 73.96 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.559 -179.002 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -90.23 -4.3 57.29 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.347 -0.221 . . . . 0.0 111.088 178.813 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -128.58 45.91 2.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.777 0.799 . . . . 0.0 112.484 -179.355 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 29.0 p -66.06 -26.91 67.71 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.426 -0.796 . . . . 0.0 112.399 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.4 -28.26 66.93 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.596 1.189 . . . . 0.0 112.465 178.383 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 91.4 t -68.69 -44.78 82.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 178.968 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.79 -37.5 79.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 178.354 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.42 -34.32 76.54 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.046 177.806 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.8 m -78.53 -39.47 37.85 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 118.48 0.582 . . . . 0.0 109.676 -179.801 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.55 HD23 HD11 ' A' ' 526' ' ' ILE . 44.0 mt -57.7 -34.92 69.96 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.962 0.41 . . . . 0.0 111.407 178.591 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -63.73 -29.13 70.39 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.879 -0.513 . . . . 0.0 111.629 175.232 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -74.02 -42.59 60.1 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 122.098 -0.376 . . . . 0.0 111.977 -179.741 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.55 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.83 -21.64 12.88 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -178.406 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . 0.417 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -65.02 -11.21 36.52 Favored 'General case' 0 C--O 1.214 -0.78 0 O-C-N 121.97 -0.456 . . . . 0.0 112.097 175.554 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 41.0 ptt85 -122.13 19.44 10.74 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 122.998 0.519 . . . . 0.0 111.596 175.334 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -65.48 120.46 12.9 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -175.606 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -85.98 -27.92 24.56 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -177.434 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.86 -41.45 95.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.245 0.545 . . . . 0.0 111.616 -175.289 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -132.35 112.5 12.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.948 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -62.62 -33.57 75.28 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.272 -179.314 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -58.17 -41.98 85.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.521 0.676 . . . . 0.0 111.34 -179.969 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 94.3 t -60.27 -41.02 85.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 O-C-N 121.876 -0.515 . . . . 0.0 109.618 178.238 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 38.1 ttm -57.8 -47.38 82.73 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 120.814 0.34 . . . . 0.0 110.122 179.073 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.24 -48.38 73.51 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.035 -179.458 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -72.03 -37.81 69.68 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 118.627 -1.229 . . . . 0.0 111.147 -175.399 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.94 -38.66 83.06 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.01 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . 0.417 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -66.83 -48.97 67.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.861 -1.063 . . . . 0.0 113.709 179.425 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -41.83 88.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -179.705 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 63.3 t -70.6 -51.03 40.52 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.593 -178.689 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -55.08 -44.74 75.11 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.597 0.237 . . . . 0.0 110.486 -177.554 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 20.7 m -67.07 -35.55 80.08 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 123.019 0.528 . . . . 0.0 110.727 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 16.0 mtt85 -60.58 -29.3 69.1 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 121.807 -0.558 . . . . 0.0 110.157 175.606 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.947 HD22 HG21 ' A' ' 508' ' ' VAL . 9.4 mt -76.2 -34.44 59.28 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 -175.603 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -31.5 70.85 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.061 178.205 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.6 m . . . . . 0 C--N 1.319 -0.73 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 176.908 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.5 m . . . . . 0 C--O 1.224 -0.268 0 CA-C-O 120.939 0.4 . . . . 0.0 111.274 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 49.9 t -54.38 -45.19 69.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.064 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 179.652 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 472' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -64.74 -34.13 77.59 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.796 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -68.0 -41.29 82.47 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 178.604 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -72.35 -32.61 66.63 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.219 -177.84 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 475' ' ' LEU . . . . . 0.421 HD23 HD21 ' A' ' 503' ' ' LEU . 1.6 tm? -56.61 -38.85 72.63 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.186 178.846 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -53.42 -40.45 65.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 118.345 0.52 . . . . 0.0 110.654 -179.065 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 56.8 tttt -67.36 -56.68 8.7 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 176.856 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -45.91 89.89 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -176.119 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -60.37 -43.32 96.67 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -179.739 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 67.4 m -62.17 -40.47 96.13 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.644 -178.574 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 481' ' ' GLU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.7 mm-40 -63.01 -38.72 92.33 Favored 'General case' 0 CA--C 1.508 -0.662 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.402 178.61 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -60.23 -43.57 93.64 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 179.472 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.41 -41.95 93.06 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.524 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -65.73 -34.33 77.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.801 0.334 . . . . 0.0 110.875 179.623 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.35 -17.13 64.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 179.398 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 486' ' ' LEU . . . . . 0.427 HD11 ' CG2' ' A' ' 526' ' ' ILE . 25.8 mt -108.59 12.14 26.17 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -178.614 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 6.0 mtpt -54.88 130.97 43.25 Favored 'General case' 0 C--O 1.209 -1.068 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 177.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.0 t -63.75 -41.17 91.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 122.468 1.127 . . . . 0.0 108.129 177.507 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -28.95 68.23 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 113.465 -1.698 . . . . 0.0 113.632 -179.337 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.3 t -159.75 76.08 2.99 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.799 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -75.56 144.5 28.53 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 116.6 -1.8 . . . . 0.0 113.535 179.407 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -137.08 104.27 5.38 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.277 0.561 . . . . 0.0 111.099 179.477 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.04 -46.09 94.69 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.934 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -57.02 -32.67 66.39 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 120.96 0.41 . . . . 0.0 109.931 -177.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -70.12 -40.29 74.94 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -176.234 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 496' ' ' CYS . . . . . 0.429 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.95 -49.04 71.91 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 176.007 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 74.9 mt -57.31 -44.1 83.85 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -175.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.62 -40.15 96.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.76 0.791 . . . . 0.0 110.336 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 499' ' ' ALA . . . . . 0.418 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -68.91 -46.92 67.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.361 0.6 . . . . 0.0 110.49 179.39 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 500' ' ' LEU . . . . . 0.429 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -55.88 -48.64 75.22 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.477 179.139 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -63.02 -35.62 80.83 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -175.483 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -69.98 -43.27 71.81 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 176.707 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 503' ' ' LEU . . . . . 0.421 HD21 HD23 ' A' ' 475' ' ' LEU . 1.5 tm? -59.29 -34.74 72.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.343 0.592 . . . . 0.0 110.336 -179.338 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.17 -17.98 62.09 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-O 119.207 -0.774 . . . . 0.0 114.745 179.78 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.3 t -112.95 -7.7 13.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.149 0.975 . . . . 0.0 111.064 -179.449 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.5 mt -72.72 148.57 44.55 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.523 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 507' ' ' GLN . . . . . 0.454 ' O ' HD13 ' A' ' 512' ' ' ILE . 34.4 tt0 -78.57 84.58 4.68 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 122.807 1.289 . . . . 0.0 109.985 178.388 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 508' ' ' VAL . . . . . 0.926 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -97.07 46.83 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.325 0 CA-C-O 122.748 1.261 . . . . 0.0 108.939 -178.181 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.0 t -67.28 172.43 4.81 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -178.244 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 15.7 m -49.36 -32.15 10.78 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -173.949 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.36 -45.3 76.52 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 122.348 -0.22 . . . . 0.0 111.528 177.799 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 512' ' ' ILE . . . . . 0.454 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.5 mp -86.86 -42.39 15.43 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.818 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 513' ' ' LEU . . . . . 0.444 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.08 -40.13 80.3 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -175.715 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -69.55 -29.43 67.01 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.354 -177.654 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -90.53 -3.34 57.67 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 122.338 -0.227 . . . . 0.0 110.979 177.537 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -128.76 45.3 2.81 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.71 0.767 . . . . 0.0 112.388 179.382 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 22.3 p -64.66 -27.35 68.86 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.881 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.39 -24.59 65.7 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 122.1 0.952 . . . . 0.0 112.207 178.167 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.5 t -71.74 -45.98 63.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 178.363 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.82 -35.54 71.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.846 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -58.21 -46.1 86.46 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 176.46 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.7 m -71.2 -39.15 71.97 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.641 -175.331 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 523' ' ' LEU . . . . . 0.668 HD23 HD11 ' A' ' 526' ' ' ILE . 72.7 mt -57.61 -35.47 70.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.884 0.373 . . . . 0.0 111.186 179.044 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -66.06 -29.12 69.41 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 121.789 -0.569 . . . . 0.0 112.382 176.912 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.92 -53.11 10.84 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.826 0.822 . . . . 0.0 110.419 179.633 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 526' ' ' ILE . . . . . 0.668 HD11 HD23 ' A' ' 523' ' ' LEU . 22.6 pt -65.47 -24.64 35.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -179.419 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.28 -16.92 61.79 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 176.004 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.73 19.2 13.24 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.791 0.437 . . . . 0.0 111.111 177.072 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -65.72 120.86 13.75 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 123.201 0.6 . . . . 0.0 111.462 -179.027 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -91.5 -19.42 22.82 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -178.126 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -69.49 -22.81 63.58 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.129 -177.754 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.68 128.98 12.0 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.749 174.774 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -64.28 -49.5 71.59 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.222 -178.454 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -58.17 -38.36 76.49 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.251 0.548 . . . . 0.0 111.808 -173.839 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.95 -44.9 79.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 176.873 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.6 ttp -68.32 -43.26 77.97 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 119.256 -0.402 . . . . 0.0 110.362 179.431 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -64.36 -47.78 78.03 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.406 -0.518 . . . . 0.0 112.354 -179.411 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -69.82 -38.09 76.46 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.42 -178.3 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.2 -40.73 86.7 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-O 121.619 0.723 . . . . 0.0 109.287 178.133 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.61 73.87 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.524 -1.217 . . . . 0.0 112.638 -179.923 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -42.48 90.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.454 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.2 t -70.5 -51.11 40.34 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.994 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.414 -178.317 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -54.49 -45.09 73.15 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -177.781 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.9 m -66.19 -35.11 79.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.297 0.57 . . . . 0.0 111.262 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 23.1 mtt85 -61.65 -30.07 70.48 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.783 -0.573 . . . . 0.0 109.947 174.933 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 546' ' ' LEU . . . . . 0.926 HD22 HG21 ' A' ' 508' ' ' VAL . 8.5 mt -76.68 -34.05 58.22 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -175.754 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -28.14 68.85 Favored 'General case' 0 C--O 1.217 -0.639 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.67 178.212 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.9 m . . . . . 0 C--N 1.316 -0.865 0 CA-C-N 114.92 -1.037 . . . . 0.0 111.991 177.769 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.576 0 N-CA-C 109.638 -0.505 . . . . 0.0 109.638 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -71.72 155.37 40.54 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 107.952 -1.129 . . . . 0.0 107.952 177.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 80.1 p -153.96 154.87 30.61 Favored Pre-proline 0 C--N 1.322 -0.608 0 N-CA-C 105.384 -2.08 . . . . 0.0 105.384 178.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -67.93 149.61 77.74 Favored 'Trans proline' 0 C--O 1.245 0.836 0 C-N-CA 116.627 -1.782 . . . . 0.0 113.189 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.2 m -69.52 167.0 17.69 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 115.227 -0.897 . . . . 0.0 111.615 -179.653 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.414 HG13 ' HB3' ' A' ' 506' ' ' LEU . 53.7 t -56.18 -47.78 80.24 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.907 0 CA-C-N 116.576 -0.284 . . . . 0.0 111.751 179.699 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -63.44 -34.18 77.18 Favored 'General case' 0 C--N 1.318 -0.794 0 N-CA-C 112.169 0.433 . . . . 0.0 112.169 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -67.16 -42.74 83.83 Favored 'General case' 0 C--N 1.324 -0.509 0 N-CA-C 108.825 -0.806 . . . . 0.0 108.825 177.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 17.5 mttt -69.43 -35.48 75.72 Favored 'General case' 0 CA--C 1.507 -0.705 0 CA-C-O 121.727 0.775 . . . . 0.0 109.997 -178.609 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.437 HD21 HG21 ' A' ' 519' ' ' VAL . 1.5 tm? -57.13 -37.42 71.99 Favored 'General case' 0 N--CA 1.445 -0.687 0 CA-C-N 114.789 -1.096 . . . . 0.0 109.879 -179.154 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -54.46 -40.68 68.63 Favored 'General case' 0 C--N 1.326 -0.444 0 C-N-CA 120.571 -0.451 . . . . 0.0 110.405 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -72.36 -54.06 10.52 Favored 'General case' 0 C--O 1.218 -0.569 0 C-N-CA 120.391 -0.524 . . . . 0.0 110.131 177.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -54.47 -46.75 73.43 Favored 'General case' 0 C--O 1.219 -0.508 0 N-CA-C 114.09 1.145 . . . . 0.0 114.09 -177.258 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.4 t-160 -61.33 -41.06 96.39 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 108.991 -0.744 . . . . 0.0 108.991 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 52.5 m -64.06 -40.57 96.56 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 121.04 -0.264 . . . . 0.0 110.97 179.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 72.3 mm-40 -63.72 -43.09 97.59 Favored 'General case' 0 CA--C 1.509 -0.63 0 CA-C-N 118.153 0.433 . . . . 0.0 110.652 178.1 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.02 -46.89 66.02 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.19 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 177.568 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 43.7 mtpt -67.01 -39.5 87.11 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 113.281 0.845 . . . . 0.0 113.281 -177.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -68.57 -28.07 66.63 Favored 'General case' 0 C--N 1.323 -0.561 0 O-C-N 122.157 -0.339 . . . . 0.0 110.755 177.855 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -70.69 -18.42 62.82 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 178.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.6 mt -105.99 12.08 30.89 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.874 -177.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 52.4 mttt -54.09 127.29 26.03 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 106.763 -1.569 . . . . 0.0 106.763 176.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.6 t -62.26 -42.11 94.07 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.637 0 CA-C-O 121.932 0.872 . . . . 0.0 109.678 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -68.33 -30.66 69.68 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 114.205 -1.362 . . . . 0.0 112.943 -178.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 14.2 t -155.31 75.9 5.17 Favored Pre-proline 0 C--O 1.244 0.769 0 N-CA-C 112.385 0.513 . . . . 0.0 112.385 -175.053 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -74.95 146.65 33.13 Favored 'Trans proline' 0 C--N 1.345 0.381 0 C-N-CA 117.394 -1.271 . . . . 0.0 112.72 179.214 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.2 t0 -137.28 100.76 4.34 Favored 'General case' 0 C--N 1.324 -0.523 0 CA-C-O 121.331 0.586 . . . . 0.0 109.762 -179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.72 -46.13 96.49 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -177.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -58.09 -31.12 66.81 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 123.064 0.227 . . . . 0.0 110.447 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 -69.28 -41.11 77.28 Favored 'General case' 0 C--N 1.322 -0.616 0 N-CA-C 108.449 -0.945 . . . . 0.0 108.449 -177.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.441 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.69 -49.04 69.99 Favored 'General case' 0 C--O 1.215 -0.762 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 176.498 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 83.4 mt -56.85 -44.18 81.91 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 111.833 0.309 . . . . 0.0 111.833 -176.325 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.07 -41.07 97.77 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 121.6 0.714 . . . . 0.0 110.824 179.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.445 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.93 -47.3 69.07 Favored 'General case' 0 C--N 1.322 -0.615 0 CA-C-O 121.286 0.565 . . . . 0.0 109.767 179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.441 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.29 -46.32 79.82 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-N 115.547 -0.751 . . . . 0.0 111.186 177.641 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -64.66 -35.36 80.79 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 119.032 0.833 . . . . 0.0 113.123 -176.171 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -68.88 -46.61 67.95 Favored 'General case' 0 C--O 1.225 -0.23 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 176.462 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.427 HD21 HD23 ' A' ' 475' ' ' LEU . 0.9 OUTLIER -57.69 -33.23 68.15 Favored 'General case' 0 CA--C 1.539 0.543 0 CA-C-O 121.427 0.632 . . . . 0.0 110.547 -179.417 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.76 -19.21 67.09 Favored Glycine 0 C--O 1.238 0.345 0 CA-C-O 119.312 -0.716 . . . . 0.0 114.543 179.21 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.7 t -109.98 -13.75 14.36 Favored 'General case' 0 C--N 1.326 -0.414 0 CA-C-N 117.91 0.855 . . . . 0.0 110.237 -179.722 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.414 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.0 mt -67.3 145.91 54.65 Favored 'General case' 0 C--N 1.327 -0.388 0 O-C-N 121.964 -0.46 . . . . 0.0 110.344 179.382 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.426 ' O ' HD13 ' A' ' 512' ' ' ILE . 28.7 tt0 -79.37 84.45 5.28 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-O 122.79 1.281 . . . . 0.0 109.809 178.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.916 HG21 HD22 ' A' ' 546' ' ' LEU . 27.8 m -95.69 46.49 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.307 -1.252 0 CA-C-O 122.9 1.333 . . . . 0.0 108.433 -179.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.4 t -66.67 171.78 4.84 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 -177.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.1 m -49.26 -30.9 7.89 Favored 'General case' 0 C--N 1.327 -0.399 0 N-CA-C 114.091 1.145 . . . . 0.0 114.091 -174.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 48.0 tt0 -56.09 -46.58 78.99 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 111.918 0.34 . . . . 0.0 111.918 175.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.426 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -86.72 -41.77 15.08 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.458 0 N-CA-C 109.107 -0.701 . . . . 0.0 109.107 -178.455 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.438 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -57.51 -39.69 77.05 Favored 'General case' 0 C--N 1.319 -0.732 0 N-CA-C 113.011 0.745 . . . . 0.0 113.011 -175.84 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 34.9 mt-30 -68.12 -31.21 70.64 Favored 'General case' 0 C--N 1.323 -0.576 0 C-N-CA 120.706 -0.398 . . . . 0.0 111.392 -178.186 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -90.38 -4.44 57.06 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 122.172 -0.33 . . . . 0.0 111.331 178.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . 0.409 ' HA ' HD22 ' A' ' 516' ' ' ASN . 7.2 m120 -127.94 41.11 3.56 Favored 'General case' 0 CA--C 1.539 0.544 0 CA-C-O 121.276 0.56 . . . . 0.0 111.458 -179.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.2 p -63.64 -27.93 69.56 Favored 'General case' 0 C--N 1.323 -0.56 0 O-C-N 121.604 -0.685 . . . . 0.0 112.776 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 -65.13 -26.41 68.18 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-O 121.617 0.722 . . . . 0.0 111.842 177.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.437 HG21 HD21 ' A' ' 475' ' ' LEU . 47.6 t -71.93 -43.15 68.71 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.195 -1.409 . . . . 0.0 107.195 179.435 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 44.9 t -62.71 -35.23 69.7 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.479 0 N-CA-C 107.663 -1.236 . . . . 0.0 107.663 178.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.65 -37.09 85.02 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-O 119.228 -0.415 . . . . 0.0 111.368 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.0 m -78.14 -37.91 44.96 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 118.991 0.814 . . . . 0.0 109.719 -179.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.568 HD23 HD11 ' A' ' 526' ' ' ILE . 39.5 mt -57.97 -35.0 70.56 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-O 121.076 0.465 . . . . 0.0 111.178 178.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.7 mtmt -64.56 -29.08 70.11 Favored 'General case' 0 CA--C 1.539 0.525 0 O-C-N 121.803 -0.561 . . . . 0.0 111.536 175.102 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 79.3 mttt -74.31 -41.62 60.83 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.568 HD11 HD23 ' A' ' 523' ' ' LEU . 1.2 pt -78.74 -23.14 13.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.103 0 N-CA-C 113.64 0.978 . . . . 0.0 113.64 -178.214 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -63.15 -13.07 32.64 Favored 'General case' 0 C--O 1.215 -0.733 0 N-CA-C 112.974 0.731 . . . . 0.0 112.974 176.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.7 ptt180 -119.14 16.35 13.23 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 122.822 0.449 . . . . 0.0 110.841 176.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -64.66 121.82 15.38 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.059 0.457 . . . . 0.0 112.103 -175.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -92.29 -25.62 18.5 Favored 'General case' 0 C--O 1.218 -0.586 0 N-CA-C 115.038 1.496 . . . . 0.0 115.038 -177.375 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.02 -25.51 65.43 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.799 -0.36 . . . . 0.0 111.637 -177.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.86 121.22 9.61 Favored 'General case' 0 C--N 1.327 -0.409 0 CA-C-O 120.915 0.388 . . . . 0.0 110.371 174.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -64.35 -39.99 94.98 Favored 'General case' 0 C--O 1.217 -0.641 0 CA-C-N 115.756 -0.657 . . . . 0.0 111.91 -176.87 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -60.68 -40.95 94.05 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.614 0.721 . . . . 0.0 111.745 -176.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 59.4 t -56.01 -43.39 75.13 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.957 177.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.7 ttp -66.27 -40.73 90.31 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 122.066 0.146 . . . . 0.0 110.621 -179.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -66.42 -48.41 70.12 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 111.668 0.247 . . . . 0.0 111.668 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.8 tptt -69.7 -38.26 76.9 Favored 'General case' 0 CA--C 1.513 -0.453 0 C-N-CA 118.977 -1.089 . . . . 0.0 110.244 -178.345 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.63 -39.87 81.75 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 177.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -67.2 -48.37 68.09 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 113.197 0.814 . . . . 0.0 113.197 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.03 -40.79 90.53 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 109.372 -0.603 . . . . 0.0 109.372 -179.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 62.1 t -70.63 -53.1 23.73 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 CA-C-N 115.837 -0.62 . . . . 0.0 111.3 -179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . 0.529 ' CE1' ' HD3' ' A' ' 547' ' ' LYS . 51.6 t80 -55.0 -41.74 71.65 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.181 0.515 . . . . 0.0 110.901 -177.213 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . 0.466 ' HA ' ' HE3' ' A' ' 547' ' ' LYS . 30.0 m -65.27 -38.55 90.63 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.141 0.496 . . . . 0.0 111.197 178.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 63.3 mtt85 -64.74 -27.05 68.64 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.536 -0.302 . . . . 0.0 111.177 177.015 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.916 HD22 HG21 ' A' ' 508' ' ' VAL . 11.9 mt -73.94 -37.8 64.45 Favored 'General case' 0 CA--C 1.5 -0.952 0 N-CA-C 108.142 -1.058 . . . . 0.0 108.142 -176.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . 0.529 ' HD3' ' CE1' ' A' ' 543' ' ' TYR . 5.2 mtmp? -63.76 -24.73 67.88 Favored 'General case' 0 C--O 1.211 -0.934 0 CA-C-N 114.824 -1.08 . . . . 0.0 111.273 178.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.8 m -81.67 -8.55 59.72 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 115.277 -0.874 . . . . 0.0 112.127 178.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 73.7 mtt85 -113.42 -15.79 12.56 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 122.512 0.325 . . . . 0.0 111.8 178.694 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -94.11 -158.74 33.74 Favored Glycine 0 N--CA 1.453 -0.226 0 CA-C-N 116.166 -0.47 . . . . 0.0 112.936 -176.62 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 20.2 m . . . . . 0 C--O 1.256 1.402 0 N-CA-C 104.335 -2.469 . . . . 0.0 104.335 178.633 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.705 0 N-CA-C 109.701 -0.481 . . . . 0.0 109.701 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -68.65 151.81 46.21 Favored 'General case' 0 C--N 1.33 -0.268 0 N-CA-C 104.703 -2.332 . . . . 0.0 104.703 174.068 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 19.2 m 47.08 59.49 16.33 Favored Pre-proline 0 N--CA 1.477 0.877 0 O-C-N 123.675 0.609 . . . . 0.0 111.938 -175.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -71.78 152.79 58.82 Favored 'Trans proline' 0 C--N 1.348 0.552 0 N-CA-C 115.884 1.455 . . . . 0.0 115.884 -174.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.1 m -70.89 166.7 20.6 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 114.821 -1.081 . . . . 0.0 111.745 178.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.422 HG13 ' HB3' ' A' ' 506' ' ' LEU . 48.6 t -53.75 -49.25 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.713 0 N-CA-C 112.855 0.687 . . . . 0.0 112.855 -179.432 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.429 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.8 pt-20 -65.92 -32.28 73.69 Favored 'General case' 0 C--N 1.316 -0.861 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.693 -178.831 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -67.47 -40.71 85.31 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 177.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 12.7 mtpt -72.32 -32.99 67.03 Favored 'General case' 0 CA--C 1.502 -0.886 0 CA-C-N 115.085 -0.961 . . . . 0.0 110.499 -176.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -55.7 -40.11 71.93 Favored 'General case' 0 C--N 1.32 -0.693 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.548 -179.455 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 77.5 mt-30 -53.23 -39.85 64.11 Favored 'General case' 0 C--N 1.324 -0.525 0 C-N-CA 121.245 -0.182 . . . . 0.0 110.895 -178.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -71.97 -55.24 7.79 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.309 -0.557 . . . . 0.0 110.265 176.291 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.0 -47.06 78.43 Favored 'General case' 0 C--O 1.218 -0.563 0 N-CA-C 114.082 1.142 . . . . 0.0 114.082 -175.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -61.47 -39.88 92.49 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 -179.37 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 59.1 m -64.92 -41.25 95.72 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.721 -0.392 . . . . 0.0 110.587 179.253 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.456 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.9 mm-40 -63.19 -43.17 98.94 Favored 'General case' 0 CA--C 1.506 -0.718 0 C-N-CA 120.997 -0.281 . . . . 0.0 110.805 178.762 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.14 -47.62 66.76 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 107.961 -1.126 . . . . 0.0 107.961 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 48.2 mtpt -67.36 -37.68 83.58 Favored 'General case' 0 C--N 1.321 -0.652 0 N-CA-C 113.109 0.781 . . . . 0.0 113.109 -176.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -67.73 -31.64 71.71 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 110.028 -0.36 . . . . 0.0 110.028 177.35 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.55 -19.09 65.24 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.179 0.437 . . . . 0.0 112.179 179.366 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 23.8 mt -103.06 12.19 36.27 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 112.692 0.627 . . . . 0.0 112.692 -179.794 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 38.6 mttt -55.57 128.52 34.93 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 107.1 -1.444 . . . . 0.0 107.1 177.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 72.2 t -61.43 -43.12 96.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.715 0 CA-C-O 121.816 0.817 . . . . 0.0 109.66 179.742 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 32.2 t70 -74.23 -19.84 60.38 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 114.469 -1.242 . . . . 0.0 113.456 -178.649 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 7.3 m -156.39 69.0 4.79 Favored Pre-proline 0 N--CA 1.47 0.574 0 N-CA-C 113.559 0.948 . . . . 0.0 113.559 -176.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 87.2 Cg_endo -75.58 145.11 29.16 Favored 'Trans proline' 0 C--N 1.345 0.357 0 C-N-CA 114.267 -3.355 . . . . 0.0 112.573 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -137.33 96.76 3.33 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.892 0.853 . . . . 0.0 109.867 -179.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.409 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.6 OUTLIER -56.32 -46.43 81.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.81 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 -178.931 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 89.6 mttt -60.35 -30.67 69.69 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 -177.582 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -69.73 -40.43 76.22 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 108.68 -0.859 . . . . 0.0 108.68 -178.037 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.456 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.97 -49.1 71.61 Favored 'General case' 0 C--O 1.216 -0.668 0 N-CA-C 108.847 -0.797 . . . . 0.0 108.847 175.814 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 87.5 mt -56.64 -43.06 79.89 Favored 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 111.949 0.352 . . . . 0.0 111.949 -176.593 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.2 t-20 -64.39 -38.54 91.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.387 0.613 . . . . 0.0 111.425 178.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.456 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.03 -48.53 68.07 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.341 -0.614 . . . . 0.0 109.341 177.803 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.456 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -56.38 -43.73 79.5 Favored 'General case' 0 N--CA 1.434 -1.27 0 CA-C-N 115.635 -0.711 . . . . 0.0 112.207 178.55 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -65.59 -33.78 76.7 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 119.315 0.961 . . . . 0.0 112.912 -177.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.98 -46.58 64.89 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 175.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.11 -34.36 65.98 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 121.44 0.638 . . . . 0.0 110.983 -179.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.92 -18.43 68.65 Favored Glycine 0 C--O 1.237 0.333 0 CA-C-O 119.235 -0.759 . . . . 0.0 114.883 -179.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 15.1 t -110.29 -14.64 14.12 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 117.992 0.896 . . . . 0.0 110.354 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.422 ' HB3' HG13 ' A' ' 471' ' ' VAL . 3.5 mt -65.39 144.01 57.36 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-O 121.0 0.428 . . . . 0.0 110.728 179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.464 ' O ' HD13 ' A' ' 512' ' ' ILE . 34.4 tt0 -78.62 84.34 4.73 Favored 'General case' 0 C--O 1.216 -0.667 0 CA-C-O 122.46 1.124 . . . . 0.0 109.192 177.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.861 HG21 HD22 ' A' ' 546' ' ' LEU . 29.5 m -97.13 46.77 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.294 0 CA-C-O 123.11 1.433 . . . . 0.0 108.922 -178.423 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.6 t -67.34 172.93 4.34 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.818 -1.549 . . . . 0.0 106.818 -179.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.3 m -49.11 -33.68 12.34 Favored 'General case' 0 C--O 1.214 -0.766 0 N-CA-C 113.801 1.037 . . . . 0.0 113.801 -173.07 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 63.5 tt0 -55.18 -43.06 73.98 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 111.725 0.268 . . . . 0.0 111.725 178.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.464 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.1 mp -88.45 -41.76 14.37 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.575 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 178.966 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.445 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.54 -39.16 83.04 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 112.917 0.71 . . . . 0.0 112.917 -174.404 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 81.1 mt-30 -67.13 -32.46 73.6 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 116.175 -0.466 . . . . 0.0 111.682 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -88.99 -3.85 58.6 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 120.999 -0.28 . . . . 0.0 110.56 178.545 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -129.01 42.73 3.27 Favored 'General case' 0 N--CA 1.468 0.447 0 N-CA-C 112.964 0.728 . . . . 0.0 112.964 -178.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.4 p -64.28 -28.16 69.53 Favored 'General case' 0 C--N 1.322 -0.621 0 O-C-N 121.499 -0.751 . . . . 0.0 112.248 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.3 m-20 -67.51 -24.05 65.53 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.506 0.67 . . . . 0.0 111.952 177.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 60.8 t -71.97 -45.13 65.29 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.697 0 N-CA-C 106.764 -1.569 . . . . 0.0 106.764 178.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 42.7 t -62.24 -35.51 69.54 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 107.745 -1.206 . . . . 0.0 107.745 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -61.01 -40.77 94.81 Favored 'General case' 0 C--N 1.326 -0.452 0 CA-C-O 119.162 -0.447 . . . . 0.0 111.175 176.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 98.6 m -74.41 -38.99 62.94 Favored 'General case' 0 CA--C 1.514 -0.436 0 CA-C-N 119.168 0.895 . . . . 0.0 110.407 179.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.676 HD23 HD11 ' A' ' 526' ' ' ILE . 63.5 mt -57.29 -35.15 69.44 Favored 'General case' 0 C--N 1.321 -0.644 0 CA-C-O 120.998 0.428 . . . . 0.0 111.334 178.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -65.7 -29.23 69.74 Favored 'General case' 0 N--CA 1.469 0.486 0 O-C-N 121.769 -0.582 . . . . 0.0 111.762 175.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 81.3 mttt -73.02 -44.42 60.9 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 120.974 0.416 . . . . 0.0 110.877 179.402 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.676 HD11 HD23 ' A' ' 523' ' ' LEU . 17.3 pt -78.54 -21.94 13.16 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.784 0 N-CA-C 114.799 1.407 . . . . 0.0 114.799 -176.023 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.45 -18.36 58.58 Favored 'General case' 0 C--O 1.214 -0.803 0 O-C-N 121.741 -0.6 . . . . 0.0 111.968 175.402 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.75 19.42 13.16 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 122.897 0.479 . . . . 0.0 111.379 178.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 14.8 t80 -64.64 113.67 3.89 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.97 0.414 . . . . 0.0 112.01 -177.191 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -75.22 -30.0 60.44 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 115.535 1.68 . . . . 0.0 115.535 -176.761 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.57 -42.25 95.77 Favored 'General case' 0 C--N 1.325 -0.46 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 -174.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.8 m120 -131.21 110.83 11.42 Favored 'General case' 0 C--N 1.323 -0.579 0 N-CA-C 110.11 -0.329 . . . . 0.0 110.11 -178.171 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 39.3 tptt -56.27 -43.85 79.19 Favored 'General case' 0 C--O 1.207 -1.139 0 CA-C-N 116.391 -0.368 . . . . 0.0 111.211 179.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.8 t0 -55.49 -42.67 74.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 121.123 0.487 . . . . 0.0 112.172 -177.026 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.1 t -57.09 -44.46 83.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.433 0 N-CA-C 109.592 -0.521 . . . . 0.0 109.592 177.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -63.87 -44.24 93.68 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.59 -47.47 78.54 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 112.259 0.466 . . . . 0.0 112.259 -179.11 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 41.5 tptt -70.27 -38.95 75.2 Favored 'General case' 0 CA--C 1.515 -0.401 0 C-N-CA 118.488 -1.285 . . . . 0.0 110.715 -178.124 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.06 -40.94 86.72 Favored 'General case' 0 C--O 1.211 -0.969 0 CA-C-O 121.368 0.604 . . . . 0.0 109.392 178.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -62.9 -48.73 77.7 Favored 'General case' 0 C--N 1.312 -1.042 0 CA-C-N 115.081 -0.963 . . . . 0.0 113.503 179.128 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.28 -41.76 89.68 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 -179.416 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.2 t -70.51 -52.81 26.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.876 0 CA-C-N 115.45 -0.796 . . . . 0.0 111.514 -177.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . 0.531 ' CE1' ' HD3' ' A' ' 547' ' ' LYS . 37.5 t80 -54.91 -42.51 72.26 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 121.343 0.592 . . . . 0.0 111.253 -177.386 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.5 m -66.95 -36.9 83.26 Favored 'General case' 0 C--N 1.32 -0.705 0 CA-C-O 120.877 0.37 . . . . 0.0 110.447 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 10.7 mtt85 -63.69 -30.06 71.21 Favored 'General case' 0 C--N 1.326 -0.447 0 CA-C-N 116.441 -0.345 . . . . 0.0 110.761 177.318 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.861 HD22 HG21 ' A' ' 508' ' ' VAL . 13.2 mt -71.7 -38.23 70.59 Favored 'General case' 0 CA--C 1.496 -1.134 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 -175.514 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . 0.531 ' HD3' ' CE1' ' A' ' 543' ' ' TYR . 4.2 mtmp? -61.08 -29.5 69.78 Favored 'General case' 0 C--N 1.321 -0.637 0 CA-C-N 114.935 -1.029 . . . . 0.0 112.317 178.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 23.6 m -74.74 -17.46 60.64 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 116.383 -0.371 . . . . 0.0 111.582 176.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 73.5 mtt85 -100.45 -33.99 10.12 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -157.03 31.81 0.55 Allowed Glycine 0 C--O 1.226 -0.384 0 N-CA-C 116.251 1.26 . . . . 0.0 116.251 -177.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 15.2 m . . . . . 0 N--CA 1.48 1.038 0 N-CA-C 114.275 1.213 . . . . 0.0 114.275 -179.565 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 109.755 -0.461 . . . . 0.0 109.755 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -75.58 156.51 34.91 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 178.069 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 30.9 p -78.52 150.07 75.91 Favored Pre-proline 0 C--N 1.323 -0.575 0 N-CA-C 107.597 -1.26 . . . . 0.0 107.597 176.738 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.74 145.37 62.9 Favored 'Trans proline' 0 C--O 1.236 0.411 0 C-N-CA 116.188 -2.075 . . . . 0.0 112.377 178.625 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 19.8 m -70.72 165.59 22.66 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.848 -0.615 . . . . 0.0 110.607 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.408 HG13 ' HB3' ' A' ' 506' ' ' LEU . 34.1 t -55.17 -46.85 77.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.019 0 O-C-N 122.114 -0.366 . . . . 0.0 110.719 178.364 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -61.26 -34.15 74.69 Favored 'General case' 0 C--N 1.317 -0.825 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 -179.402 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -67.03 -40.93 87.31 Favored 'General case' 0 CA--C 1.51 -0.58 0 CA-C-O 122.378 1.085 . . . . 0.0 108.678 179.135 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.4 mtpt -74.08 -34.8 64.13 Favored 'General case' 0 C--N 1.319 -0.726 0 CA-C-N 114.895 -1.048 . . . . 0.0 109.35 -177.626 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.567 HD21 HG21 ' A' ' 519' ' ' VAL . 4.2 tt -58.88 -36.82 75.28 Favored 'General case' 0 C--O 1.208 -1.11 0 CA-C-N 114.724 -1.125 . . . . 0.0 109.244 177.787 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 58.0 mt-30 -57.58 -41.58 81.41 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 119.244 0.929 . . . . 0.0 109.908 178.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -68.07 -53.18 27.44 Favored 'General case' 0 N--CA 1.466 0.337 0 C-N-CA 120.752 -0.379 . . . . 0.0 110.618 178.785 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.86 -46.34 84.96 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 112.135 0.42 . . . . 0.0 112.135 -179.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.45 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.8 t-160 -58.41 -44.71 89.13 Favored 'General case' 0 C--N 1.32 -0.689 0 N-CA-C 109.014 -0.735 . . . . 0.0 109.014 -179.37 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.0 m -63.17 -38.59 91.77 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 111.549 0.203 . . . . 0.0 111.549 -179.087 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.57 -37.57 88.01 Favored 'General case' 0 CA--C 1.498 -1.03 0 C-N-CA 120.703 -0.399 . . . . 0.0 110.75 178.287 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.7 mt -58.95 -42.26 85.51 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.053 0 N-CA-C 106.866 -1.531 . . . . 0.0 106.866 179.182 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 22.4 mmtt -64.9 -45.36 86.27 Favored 'General case' 0 N--CA 1.477 0.924 0 CA-C-O 120.864 0.364 . . . . 0.0 111.7 -179.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.6 m-85 -66.9 -28.51 68.37 Favored 'General case' 0 C--N 1.324 -0.538 0 CA-C-N 116.406 -0.361 . . . . 0.0 111.414 -178.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -69.96 -17.81 63.32 Favored 'General case' 0 C--N 1.319 -0.721 0 C-N-CA 122.722 0.409 . . . . 0.0 111.912 178.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.8 mt -109.63 12.14 24.39 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.233 -0.44 . . . . 0.0 111.605 -176.732 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 66.9 mttt -53.25 128.29 27.54 Favored 'General case' 0 C--O 1.212 -0.875 0 N-CA-C 106.699 -1.593 . . . . 0.0 106.699 177.226 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.3 t -60.31 -42.36 90.4 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.686 0 CA-C-O 121.825 0.822 . . . . 0.0 109.672 -179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 37.3 t70 -71.88 -24.87 61.74 Favored 'General case' 0 C--N 1.319 -0.757 0 CA-C-N 114.378 -1.283 . . . . 0.0 113.168 -177.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 46.5 m -156.34 72.7 5.0 Favored Pre-proline 0 C--O 1.244 0.814 0 N-CA-C 113.601 0.963 . . . . 0.0 113.601 -176.068 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 86.8 Cg_endo -71.93 144.66 43.55 Favored 'Trans proline' 0 CA--C 1.533 0.433 0 C-N-CA 115.95 -2.234 . . . . 0.0 112.484 178.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -137.23 102.04 4.71 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 121.114 0.483 . . . . 0.0 109.874 -178.915 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -61.08 -47.33 94.05 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.882 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -178.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 53.0 mtpt -57.26 -31.16 65.29 Favored 'General case' 0 CA--C 1.508 -0.655 0 O-C-N 123.118 0.261 . . . . 0.0 110.497 -178.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 41.3 ttm180 -69.38 -40.88 77.14 Favored 'General case' 0 C--N 1.321 -0.649 0 N-CA-C 108.499 -0.926 . . . . 0.0 108.499 -177.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.403 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.26 -49.56 69.12 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 176.479 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 70.2 mt -56.89 -44.13 82.01 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.068 0.396 . . . . 0.0 112.068 -176.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 22.3 t30 -61.45 -39.14 89.75 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.681 0.753 . . . . 0.0 111.749 179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -72.18 -46.58 55.77 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 121.372 0.606 . . . . 0.0 109.831 178.235 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.403 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.62 -48.67 71.92 Favored 'General case' 0 N--CA 1.429 -1.486 0 CA-C-N 115.66 -0.7 . . . . 0.0 110.925 178.335 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -60.84 -35.99 77.97 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 113.487 0.921 . . . . 0.0 113.487 -175.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.13 -47.08 53.73 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 177.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.03 -34.48 68.23 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 121.335 0.588 . . . . 0.0 110.153 -179.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.51 -14.53 64.78 Favored Glycine 0 C--O 1.236 0.224 0 N-CA-C 115.339 0.896 . . . . 0.0 115.339 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 15.1 t -111.97 -16.92 13.0 Favored 'General case' 0 C--N 1.325 -0.483 0 CA-C-N 117.767 0.783 . . . . 0.0 110.493 178.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.408 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.6 mt -63.88 150.8 44.13 Favored 'General case' 0 CA--C 1.534 0.364 0 O-C-N 122.213 -0.304 . . . . 0.0 110.947 -178.544 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.464 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.2 tt0 -79.51 84.53 5.37 Favored 'General case' 0 C--O 1.216 -0.674 0 CA-C-O 122.6 1.19 . . . . 0.0 109.188 178.136 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.896 HG21 HD22 ' A' ' 546' ' ' LEU . 30.0 m -101.04 48.21 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.279 0 CA-C-O 123.367 1.556 . . . . 0.0 108.029 -178.244 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 13.7 t -67.79 171.86 6.03 Favored 'General case' 0 C--N 1.315 -0.921 0 N-CA-C 106.17 -1.789 . . . . 0.0 106.17 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.1 m -49.23 -31.0 7.89 Favored 'General case' 0 C--O 1.214 -0.79 0 N-CA-C 113.87 1.063 . . . . 0.0 113.87 -173.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.5 tt0 -55.45 -44.1 76.06 Favored 'General case' 0 C--N 1.324 -0.53 0 O-C-N 122.292 -0.255 . . . . 0.0 111.558 177.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.464 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.6 -42.36 14.68 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.543 0 CA-C-O 121.683 0.754 . . . . 0.0 109.275 179.215 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.466 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.11 -40.86 82.26 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 113.497 0.925 . . . . 0.0 113.497 -174.273 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 97.6 mt-30 -72.48 -28.74 63.09 Favored 'General case' 0 C--N 1.32 -0.717 0 CA-C-N 116.011 -0.54 . . . . 0.0 111.399 -175.694 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.0 ptmt -88.6 -9.16 53.16 Favored 'General case' 0 N--CA 1.469 0.518 0 O-C-N 122.198 -0.314 . . . . 0.0 110.762 176.686 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.4 m120 -125.53 39.71 3.9 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-O 121.486 0.66 . . . . 0.0 111.402 -177.962 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -62.78 -23.87 67.44 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 113.42 0.896 . . . . 0.0 113.42 -178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.67 -31.46 72.69 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-O 121.995 0.902 . . . . 0.0 112.365 178.046 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.567 HG21 HD21 ' A' ' 475' ' ' LEU . 60.2 t -70.26 -41.76 78.76 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 N-CA-C 107.281 -1.377 . . . . 0.0 107.281 179.02 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 42.0 t -63.39 -37.71 80.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.581 0 N-CA-C 108.254 -1.017 . . . . 0.0 108.254 178.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.2 -34.11 77.33 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.26 -0.427 . . . . 0.0 110.593 177.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 88.0 m -76.59 -39.39 52.72 Favored 'General case' 0 C--O 1.219 -0.509 0 O-C-N 122.172 -0.33 . . . . 0.0 110.414 179.41 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.664 HD23 HD11 ' A' ' 526' ' ' ILE . 57.9 mt -59.16 -35.0 72.76 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-O 121.215 0.531 . . . . 0.0 110.734 178.94 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -63.47 -29.14 70.47 Favored 'General case' 0 CA--C 1.539 0.554 0 O-C-N 122.007 -0.433 . . . . 0.0 111.159 175.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -73.82 -42.72 60.49 Favored 'General case' 0 N--CA 1.475 0.787 0 N-CA-C 112.066 0.395 . . . . 0.0 112.066 179.096 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.664 HD11 HD23 ' A' ' 523' ' ' LEU . 1.5 pt -78.77 -23.06 12.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.02 0 N-CA-C 114.57 1.322 . . . . 0.0 114.57 -178.238 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.427 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.37 -13.96 34.9 Favored 'General case' 0 C--O 1.214 -0.791 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 177.039 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 35.8 ptt180 -118.59 15.83 13.69 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.094 0.558 . . . . 0.0 111.401 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 29.4 t80 -69.46 116.93 10.44 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 122.889 0.476 . . . . 0.0 111.409 -176.334 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 65.3 mttp -92.35 -16.44 26.0 Favored 'General case' 0 C--O 1.217 -0.605 0 N-CA-C 115.208 1.559 . . . . 0.0 115.208 -177.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -69.5 -22.23 63.62 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 120.372 -0.531 . . . . 0.0 110.472 -178.49 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -150.38 126.27 10.44 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.584 0.231 . . . . 0.0 110.654 174.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -63.06 -49.29 75.13 Favored 'General case' 0 C--O 1.21 -0.979 0 CA-C-N 116.118 -0.492 . . . . 0.0 111.049 -178.225 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -57.14 -39.31 74.94 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.259 0.552 . . . . 0.0 111.94 -174.229 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 56.1 t -55.88 -45.35 79.81 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.488 0 O-C-N 122.057 -0.402 . . . . 0.0 110.024 176.727 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.2 ttp -67.29 -44.0 80.32 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 119.407 -0.33 . . . . 0.0 110.2 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.7 mm-40 -64.04 -47.4 80.35 Favored 'General case' 0 C--N 1.322 -0.601 0 N-CA-C 112.627 0.603 . . . . 0.0 112.627 -179.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.2 tptt -70.3 -37.99 74.88 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 119.245 -0.982 . . . . 0.0 110.954 -179.236 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.56 -40.93 84.42 Favored 'General case' 0 C--O 1.215 -0.734 0 CA-C-O 121.83 0.824 . . . . 0.0 108.813 178.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.427 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.78 -51.11 66.31 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-N 114.144 -1.389 . . . . 0.0 113.921 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.58 -43.75 84.83 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 -179.368 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.3 t -68.93 -52.16 37.24 Favored 'Isoleucine or valine' 0 CA--C 1.501 -0.93 0 CA-C-N 116.027 -0.533 . . . . 0.0 111.449 -177.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -54.56 -46.04 73.59 Favored 'General case' 0 C--N 1.32 -0.695 0 CA-C-O 120.583 0.23 . . . . 0.0 110.534 -177.457 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 41.3 m -64.67 -36.56 84.67 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 123.639 0.776 . . . . 0.0 111.443 179.361 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 92.8 mtt180 -63.73 -27.84 69.48 Favored 'General case' 0 C--N 1.319 -0.753 0 O-C-N 121.649 -0.657 . . . . 0.0 110.704 175.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.896 HD22 HG21 ' A' ' 508' ' ' VAL . 11.5 mt -74.47 -36.23 63.29 Favored 'General case' 0 C--O 1.206 -1.216 0 N-CA-C 106.742 -1.577 . . . . 0.0 106.742 -177.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.75 -30.62 70.12 Favored 'General case' 0 C--O 1.216 -0.688 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.459 178.74 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.2 m -80.1 -15.73 56.51 Favored 'General case' 0 C--N 1.318 -0.79 0 CA-C-N 115.412 -0.813 . . . . 0.0 111.888 178.296 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 57.6 mtt85 -99.67 -28.76 13.03 Favored 'General case' 0 N--CA 1.473 0.697 0 N-CA-C 112.398 0.518 . . . . 0.0 112.398 179.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . 175.66 -176.41 47.44 Favored Glycine 0 C--O 1.236 0.227 0 N-CA-C 112.171 -0.371 . . . . 0.0 112.171 -178.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 71.7 m . . . . . 0 C--O 1.245 0.864 0 CA-C-O 116.848 -1.548 . . . . 0.0 107.449 178.903 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.6 0 N-CA-C 109.668 -0.493 . . . . 0.0 109.668 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -76.56 152.11 36.08 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 107.734 -1.21 . . . . 0.0 107.734 177.675 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 50.5 m -82.99 146.85 52.87 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 107.17 -1.419 . . . . 0.0 107.17 176.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -68.63 152.09 74.72 Favored 'Trans proline' 0 C--O 1.246 0.921 0 C-N-CA 116.277 -2.015 . . . . 0.0 113.171 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.4 m -69.93 164.01 24.75 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-N 114.82 -1.082 . . . . 0.0 111.805 -178.293 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 46.9 t -55.93 -47.01 80.51 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.974 0 N-CA-C 112.211 0.448 . . . . 0.0 112.211 -179.654 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.42 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.2 pt-20 -66.63 -34.17 77.27 Favored 'General case' 0 C--N 1.317 -0.805 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -179.368 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -66.16 -40.27 90.41 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 177.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 23.3 mttt -71.46 -34.69 70.45 Favored 'General case' 0 CA--C 1.509 -0.609 0 CA-C-O 121.64 0.733 . . . . 0.0 110.342 -179.541 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -57.12 -39.78 75.8 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 114.934 -1.03 . . . . 0.0 109.437 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -53.63 -38.52 64.15 Favored 'General case' 0 C--N 1.323 -0.564 0 C-N-CA 121.174 -0.21 . . . . 0.0 110.938 -179.014 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -72.96 -54.22 9.2 Favored 'General case' 0 C--O 1.221 -0.397 0 C-N-CA 120.78 -0.368 . . . . 0.0 110.012 175.941 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.81 -48.07 76.04 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 114.064 1.135 . . . . 0.0 114.064 -176.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 17.2 t-160 -61.85 -40.73 96.37 Favored 'General case' 0 C--N 1.319 -0.751 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 -179.332 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 66.8 m -63.86 -41.07 97.87 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 120.742 -0.383 . . . . 0.0 110.612 179.686 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.73 -41.92 95.59 Favored 'General case' 0 CA--C 1.5 -0.961 0 C-N-CA 120.858 -0.337 . . . . 0.0 111.017 178.544 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.73 -46.14 73.81 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.273 0 N-CA-C 107.849 -1.167 . . . . 0.0 107.849 177.253 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.4 mtpt -67.78 -39.52 84.08 Favored 'General case' 0 C--N 1.32 -0.682 0 N-CA-C 113.199 0.814 . . . . 0.0 113.199 -177.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -68.48 -30.55 69.42 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-O 120.717 0.294 . . . . 0.0 110.621 177.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.17 -18.84 65.45 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.101 0.408 . . . . 0.0 112.101 178.624 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.6 mt -105.35 12.09 32.03 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -178.345 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 72.6 mttt -54.82 130.56 41.43 Favored 'General case' 0 C--O 1.21 -1.006 0 N-CA-C 107.252 -1.388 . . . . 0.0 107.252 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.1 t -63.93 -41.19 91.7 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.761 0 CA-C-O 122.152 0.977 . . . . 0.0 109.063 178.466 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -68.64 -28.49 66.94 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.919 -1.492 . . . . 0.0 113.24 -178.022 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 66.3 m -158.93 76.2 3.28 Favored Pre-proline 0 N--CA 1.469 0.501 0 N-CA-C 112.287 0.477 . . . . 0.0 112.287 -176.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_endo -71.66 146.64 49.38 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 115.702 -2.399 . . . . 0.0 111.794 178.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -137.31 91.32 2.6 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.749 0.785 . . . . 0.0 110.14 -175.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.4 HG12 ' H ' ' A' ' 493' ' ' VAL . 1.3 p -57.21 -46.97 84.97 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 113.895 1.072 . . . . 0.0 113.895 -177.439 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -58.87 -30.97 68.13 Favored 'General case' 0 CA--C 1.508 -0.663 0 N-CA-C 110.2 -0.296 . . . . 0.0 110.2 -177.681 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 61.7 ttm-85 -70.2 -41.91 73.06 Favored 'General case' 0 C--N 1.321 -0.642 0 N-CA-C 109.115 -0.698 . . . . 0.0 109.115 -178.154 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.444 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.02 -49.46 72.3 Favored 'General case' 0 C--O 1.213 -0.817 0 N-CA-C 108.713 -0.847 . . . . 0.0 108.713 176.56 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.7 mt -57.3 -42.61 82.11 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 111.952 0.353 . . . . 0.0 111.952 -176.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.5 t-20 -65.17 -39.18 92.58 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 121.369 0.604 . . . . 0.0 111.407 178.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.62 -47.65 69.03 Favored 'General case' 0 C--N 1.321 -0.646 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 178.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.444 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.21 -44.78 79.83 Favored 'General case' 0 N--CA 1.43 -1.446 0 CA-C-N 115.72 -0.673 . . . . 0.0 111.389 177.638 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -66.8 -34.31 77.55 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 119.264 0.938 . . . . 0.0 113.493 -176.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 8.0 tt0 -69.1 -45.11 71.05 Favored 'General case' 0 C--O 1.225 -0.216 0 N-CA-C 107.13 -1.433 . . . . 0.0 107.13 176.215 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.59 -33.37 66.13 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-O 121.543 0.687 . . . . 0.0 110.069 178.683 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.25 -16.17 64.34 Favored Glycine 0 N--CA 1.452 -0.28 0 CA-C-O 119.181 -0.788 . . . . 0.0 114.656 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.7 t -114.82 -12.44 12.1 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 118.311 1.056 . . . . 0.0 110.815 179.346 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.1 mt -67.47 144.92 55.46 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.752 -0.593 . . . . 0.0 111.179 179.588 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.422 ' O ' HD13 ' A' ' 512' ' ' ILE . 2.2 mt-30 -76.44 84.35 3.17 Favored 'General case' 0 C--O 1.215 -0.738 0 CA-C-O 122.684 1.231 . . . . 0.0 109.279 177.07 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.914 HG21 HD22 ' A' ' 546' ' ' LEU . 29.1 m -97.99 46.91 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.189 0 CA-C-O 122.596 1.189 . . . . 0.0 109.127 -178.283 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.7 t -67.41 172.84 4.5 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 107.359 -1.348 . . . . 0.0 107.359 -177.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 46.1 m -49.32 -33.92 14.42 Favored 'General case' 0 C--O 1.218 -0.596 0 N-CA-C 113.292 0.849 . . . . 0.0 113.292 -174.313 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.2 tt0 -53.33 -44.86 68.78 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 112.137 0.421 . . . . 0.0 112.137 177.456 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.422 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.35 -42.6 14.93 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.464 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 179.418 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.435 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.28 -39.17 78.54 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 113.623 0.971 . . . . 0.0 113.623 -175.196 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -70.26 -29.71 66.56 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.585 -0.279 . . . . 0.0 111.114 -177.807 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.5 ptmt -90.16 -2.45 58.07 Favored 'General case' 0 N--CA 1.472 0.647 0 O-C-N 122.345 -0.222 . . . . 0.0 110.95 177.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 40.5 m-80 -129.61 45.48 2.8 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-O 121.759 0.79 . . . . 0.0 111.999 179.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.4 p -64.84 -28.53 69.62 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.731 -0.606 . . . . 0.0 112.515 -179.236 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -67.04 -26.27 66.68 Favored 'General case' 0 N--CA 1.471 0.584 0 CA-C-O 121.508 0.671 . . . . 0.0 111.885 178.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 60.6 t -69.84 -43.42 79.74 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.665 0 N-CA-C 106.814 -1.55 . . . . 0.0 106.814 178.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 41.6 t -63.85 -35.43 73.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 N-CA-C 107.904 -1.147 . . . . 0.0 107.904 178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.63 -38.21 89.32 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 119.305 -0.378 . . . . 0.0 110.963 177.383 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.6 m -75.43 -39.24 59.13 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 118.999 0.818 . . . . 0.0 109.654 -179.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.525 HD23 HD11 ' A' ' 526' ' ' ILE . 46.8 mt -57.57 -35.0 69.8 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 121.03 0.443 . . . . 0.0 111.394 178.395 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.3 mtmt -64.66 -29.16 70.15 Favored 'General case' 0 CA--C 1.537 0.469 0 O-C-N 121.878 -0.514 . . . . 0.0 111.561 175.18 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 80.8 mttt -73.4 -49.02 29.27 Favored 'General case' 0 N--CA 1.474 0.755 0 CA-C-O 120.622 0.248 . . . . 0.0 110.984 179.046 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.525 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -73.34 -21.9 19.01 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.963 0 N-CA-C 115.323 1.601 . . . . 0.0 115.323 -175.326 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.442 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -60.45 -18.35 50.72 Favored 'General case' 0 C--O 1.214 -0.785 0 N-CA-C 112.404 0.52 . . . . 0.0 112.404 176.639 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 9.8 ptp85 -118.81 19.37 13.14 Favored 'General case' 0 N--CA 1.47 0.559 0 C-N-CA 122.911 0.484 . . . . 0.0 111.279 176.711 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -63.19 113.6 3.27 Favored 'General case' 0 C--O 1.221 -0.403 0 CA-C-O 121.156 0.503 . . . . 0.0 111.842 -176.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -75.54 -30.97 59.91 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 115.686 1.736 . . . . 0.0 115.686 -176.009 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.65 -42.43 95.44 Favored 'General case' 0 C--N 1.326 -0.438 0 CA-C-O 121.032 0.444 . . . . 0.0 112.159 -174.774 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -129.88 109.81 11.2 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.804 -0.443 . . . . 0.0 109.804 -178.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.4 tptt -56.06 -42.47 76.7 Favored 'General case' 0 C--O 1.21 -1.007 0 CA-C-N 116.545 -0.298 . . . . 0.0 110.938 178.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -55.7 -43.08 76.12 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.154 0.502 . . . . 0.0 111.795 -177.343 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 69.2 t -57.99 -43.74 85.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 177.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -62.62 -44.63 95.8 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 109.999 -0.371 . . . . 0.0 109.999 179.451 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.78 -47.74 77.02 Favored 'General case' 0 C--N 1.323 -0.573 0 C-N-CA 120.605 -0.438 . . . . 0.0 112.013 -179.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 39.6 tptt -68.59 -39.94 80.72 Favored 'General case' 0 C--O 1.222 -0.351 0 C-N-CA 119.033 -1.067 . . . . 0.0 110.854 -178.407 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.42 -41.11 88.76 Favored 'General case' 0 C--O 1.215 -0.721 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 178.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.442 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.26 -48.33 78.63 Favored 'General case' 0 C--N 1.316 -0.857 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.51 -42.15 95.81 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.253 0.549 . . . . 0.0 109.681 -179.408 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 77.3 t -70.57 -51.63 35.68 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.734 0 CA-C-N 115.878 -0.601 . . . . 0.0 111.456 -178.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -53.44 -45.26 69.4 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 122.526 0.33 . . . . 0.0 110.841 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 22.6 m -65.03 -36.91 85.9 Favored 'General case' 0 C--N 1.324 -0.532 0 C-N-CA 122.925 0.49 . . . . 0.0 111.342 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 42.2 mtt85 -62.0 -28.95 69.93 Favored 'General case' 0 C--N 1.324 -0.54 0 O-C-N 121.672 -0.643 . . . . 0.0 110.661 176.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.914 HD22 HG21 ' A' ' 508' ' ' VAL . 5.5 mt -76.51 -31.72 57.84 Favored 'General case' 0 CA--C 1.503 -0.852 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 -176.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.56 -31.64 72.48 Favored 'General case' 0 C--O 1.209 -1.048 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.81 177.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 16.2 m -81.64 -8.53 59.72 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 113.789 1.033 . . . . 0.0 113.789 177.017 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 97.7 mtt180 -110.96 -16.9 13.42 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.962 0.727 . . . . 0.0 112.962 -177.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -118.82 177.44 16.41 Favored Glycine 0 N--CA 1.45 -0.416 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -178.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.254 1.317 0 C-N-CA 126.689 1.996 . . . . 0.0 106.888 -178.155 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.761 0 CA-C-O 118.592 -0.718 . . . . 0.0 109.568 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 54.47 32.28 16.41 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-O 121.836 0.827 . . . . 0.0 109.85 -176.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 62.8 p -140.43 67.39 31.08 Favored Pre-proline 0 C--N 1.326 -0.45 0 CA-C-N 115.04 -0.982 . . . . 0.0 110.463 -175.354 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 69.5 Cg_endo -69.41 148.82 68.2 Favored 'Trans proline' 0 C--O 1.238 0.507 0 C-N-CA 116.918 -1.588 . . . . 0.0 113.112 -178.703 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.7 m -69.49 161.41 29.56 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.612 -0.722 . . . . 0.0 110.891 -179.535 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.4 t -54.25 -45.91 67.88 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.114 0 N-CA-C 111.925 0.343 . . . . 0.0 111.925 179.377 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -65.03 -34.07 77.55 Favored 'General case' 0 C--N 1.316 -0.887 0 N-CA-C 112.023 0.379 . . . . 0.0 112.023 -178.03 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -66.44 -41.36 89.27 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 107.525 -1.287 . . . . 0.0 107.525 177.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.6 mtpt -73.21 -33.3 65.3 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-N 115.032 -0.986 . . . . 0.0 109.808 -176.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.476 HD21 HG21 ' A' ' 519' ' ' VAL . 5.1 tt -59.69 -35.49 74.6 Favored 'General case' 0 C--O 1.21 -0.98 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.631 178.05 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -58.12 -40.27 80.81 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 119.037 0.835 . . . . 0.0 110.053 178.586 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 47.0 tttt -65.32 -55.83 16.09 Favored 'General case' 0 N--CA 1.468 0.45 0 N-CA-C 109.582 -0.525 . . . . 0.0 109.582 177.403 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.34 -45.8 90.37 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 113.137 0.791 . . . . 0.0 113.137 -177.194 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.445 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.9 t-160 -58.61 -42.72 88.82 Favored 'General case' 0 C--N 1.317 -0.836 0 N-CA-C 108.871 -0.789 . . . . 0.0 108.871 -179.361 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 53.9 m -64.63 -39.08 93.07 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 121.197 -0.201 . . . . 0.0 111.434 -178.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.415 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.3 mm-40 -63.54 -37.67 88.18 Favored 'General case' 0 CA--C 1.508 -0.653 0 C-N-CA 120.754 -0.378 . . . . 0.0 110.6 178.589 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.6 mt -59.17 -43.02 88.55 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 N-CA-C 107.286 -1.375 . . . . 0.0 107.286 179.36 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -63.45 -44.92 93.11 Favored 'General case' 0 N--CA 1.479 0.988 0 N-CA-C 111.896 0.332 . . . . 0.0 111.896 -179.371 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.75 -32.4 73.92 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.79 0.329 . . . . 0.0 110.979 -178.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.58 -17.34 64.6 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 112.63 0.604 . . . . 0.0 112.63 179.247 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.3 mt -109.69 12.06 24.33 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 112.013 0.375 . . . . 0.0 112.013 -177.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 68.9 mttt -55.29 132.4 47.81 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 107.401 -1.333 . . . . 0.0 107.401 177.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 56.1 t -63.73 -41.45 92.62 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.75 0 CA-C-O 122.316 1.055 . . . . 0.0 108.723 177.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -66.42 -31.22 71.85 Favored 'General case' 0 C--N 1.318 -0.761 0 CA-C-N 113.519 -1.673 . . . . 0.0 113.152 -178.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 11.1 t -160.48 76.97 2.65 Favored Pre-proline 0 C--N 1.325 -0.494 0 N-CA-C 112.52 0.563 . . . . 0.0 112.52 -175.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -73.99 144.95 34.94 Favored 'Trans proline' 0 CA--C 1.531 0.358 0 C-N-CA 116.68 -1.747 . . . . 0.0 112.716 178.464 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -137.34 102.24 4.74 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-O 121.685 0.755 . . . . 0.0 110.88 -179.684 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.446 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.5 OUTLIER -60.11 -45.39 95.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 N-CA-C 112.773 0.657 . . . . 0.0 112.773 -179.098 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -59.66 -31.9 69.97 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 109.57 -0.529 . . . . 0.0 109.57 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -70.1 -41.13 74.43 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -177.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.4 OUTLIER -64.89 -48.75 73.1 Favored 'General case' 0 C--O 1.216 -0.706 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 176.125 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 87.5 mt -56.94 -44.59 82.66 Favored 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 112.094 0.405 . . . . 0.0 112.094 -176.369 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 43.4 t30 -63.16 -39.04 93.51 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.799 0.809 . . . . 0.0 111.446 179.777 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.71 -47.27 63.74 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.448 0.642 . . . . 0.0 109.934 178.693 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.59 -48.26 75.13 Favored 'General case' 0 N--CA 1.428 -1.528 0 CA-C-N 115.38 -0.827 . . . . 0.0 110.641 178.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -62.36 -36.6 82.73 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 113.252 0.834 . . . . 0.0 113.252 -175.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.7 tt0 -70.05 -45.7 66.55 Favored 'General case' 0 C--O 1.225 -0.236 0 N-CA-C 108.211 -1.033 . . . . 0.0 108.211 177.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -57.38 -35.77 70.42 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.295 0.569 . . . . 0.0 110.054 -179.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.91 -17.65 67.75 Favored Glycine 0 C--O 1.244 0.762 0 N-CA-C 115.288 0.875 . . . . 0.0 115.288 179.984 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.9 t -108.56 -13.43 14.83 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-N 117.512 0.656 . . . . 0.0 109.822 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 3.1 mt -69.99 149.47 47.7 Favored 'General case' 0 C--O 1.237 0.401 0 N-CA-C 109.519 -0.548 . . . . 0.0 109.519 179.163 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.466 ' O ' HD13 ' A' ' 512' ' ' ILE . 35.4 tt0 -79.82 84.39 5.62 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-O 122.56 1.172 . . . . 0.0 109.281 177.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.941 HG21 HD22 ' A' ' 546' ' ' LEU . 27.3 m -98.16 47.93 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.3 0 CA-C-O 123.247 1.499 . . . . 0.0 107.608 -179.585 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.9 t -66.31 173.68 3.09 Favored 'General case' 0 C--N 1.314 -0.935 0 CA-C-N 113.807 -1.542 . . . . 0.0 107.167 -179.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.3 m -49.38 -34.67 16.69 Favored 'General case' 0 C--O 1.215 -0.713 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -173.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -54.28 -45.15 72.43 Favored 'General case' 0 CA--C 1.541 0.62 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 177.623 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.466 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -86.52 -40.0 13.84 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.665 0 CA-C-O 121.691 0.758 . . . . 0.0 109.324 179.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.4 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.79 -38.16 81.13 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 112.985 0.735 . . . . 0.0 112.985 -175.979 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -67.1 -35.0 78.84 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-N 116.278 -0.419 . . . . 0.0 111.348 -179.08 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -86.83 -6.86 58.67 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 120.833 -0.347 . . . . 0.0 111.116 179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 45.1 m-80 -128.74 45.64 2.75 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-O 121.914 0.864 . . . . 0.0 112.924 -177.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.9 p -65.0 -24.23 67.45 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.357 179.513 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.08 -33.84 76.68 Favored 'General case' 0 N--CA 1.473 0.695 0 CA-C-O 122.56 1.172 . . . . 0.0 112.231 178.322 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.476 HG21 HD21 ' A' ' 475' ' ' LEU . 86.1 t -68.43 -43.45 84.0 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 107.353 -1.351 . . . . 0.0 107.353 179.487 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.3 t -63.43 -37.1 78.66 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 178.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.36 -36.68 84.53 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-N 116.456 -0.338 . . . . 0.0 110.582 177.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.6 m -75.58 -39.73 57.64 Favored 'General case' 0 C--O 1.218 -0.564 0 CA-C-N 118.215 0.461 . . . . 0.0 109.797 -179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.59 HD23 HD11 ' A' ' 526' ' ' ILE . 55.4 mt -58.19 -34.88 70.84 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.921 0.391 . . . . 0.0 111.257 178.651 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.9 mtmt -64.22 -29.07 70.19 Favored 'General case' 0 N--CA 1.468 0.44 0 O-C-N 121.858 -0.526 . . . . 0.0 111.317 175.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -73.76 -46.02 48.27 Favored 'General case' 0 N--CA 1.472 0.644 0 CA-C-O 120.72 0.295 . . . . 0.0 111.401 179.381 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.59 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -77.49 -20.6 14.07 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.164 0 N-CA-C 114.39 1.256 . . . . 0.0 114.39 -176.956 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.466 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.21 -15.6 47.74 Favored 'General case' 0 C--O 1.211 -0.957 0 O-C-N 121.952 -0.467 . . . . 0.0 112.156 176.056 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.0 ptp180 -119.21 19.33 12.88 Favored 'General case' 0 N--CA 1.469 0.477 0 C-N-CA 123.155 0.582 . . . . 0.0 111.456 176.067 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.4 t80 -63.75 116.25 5.55 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.276 0.56 . . . . 0.0 112.294 -175.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -83.18 -27.99 29.65 Favored 'General case' 0 C--O 1.216 -0.667 0 N-CA-C 115.077 1.51 . . . . 0.0 115.077 -177.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.26 -27.38 66.28 Favored 'General case' 0 C--O 1.221 -0.412 0 N-CA-C 112.578 0.584 . . . . 0.0 112.578 -174.981 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -147.97 114.94 6.12 Favored 'General case' 0 C--N 1.326 -0.446 0 N-CA-C 108.408 -0.96 . . . . 0.0 108.408 177.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 13.3 tmtt? -63.12 -38.27 90.5 Favored 'General case' 0 C--O 1.217 -0.623 0 N-CA-C 112.059 0.392 . . . . 0.0 112.059 -175.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 67.8 m-20 -58.77 -38.94 79.59 Favored 'General case' 0 C--N 1.322 -0.623 0 CA-C-O 120.919 0.39 . . . . 0.0 111.481 -177.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.6 t -58.47 -44.64 89.4 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.538 0 N-CA-C 109.251 -0.648 . . . . 0.0 109.251 177.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 3.3 ttp -64.22 -42.03 96.76 Favored 'General case' 0 CA--C 1.51 -0.564 0 N-CA-C 110.445 -0.206 . . . . 0.0 110.445 -179.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -63.3 -49.43 74.04 Favored 'General case' 0 C--N 1.32 -0.713 0 O-C-N 123.191 0.307 . . . . 0.0 111.164 179.793 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.6 tptt -71.33 -38.05 71.7 Favored 'General case' 0 C--O 1.218 -0.555 0 C-N-CA 118.868 -1.133 . . . . 0.0 111.335 -178.796 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.7 -40.91 85.02 Favored 'General case' 0 C--O 1.212 -0.888 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 178.583 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.466 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.7 -51.12 66.42 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 114.748 -1.115 . . . . 0.0 113.904 178.263 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.69 -44.03 90.16 Favored 'General case' 0 C--N 1.319 -0.756 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 -179.437 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.7 t -67.4 -51.23 54.56 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.957 0 CA-C-N 116.124 -0.489 . . . . 0.0 110.811 -177.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 47.7 t80 -54.26 -44.67 72.0 Favored 'General case' 0 C--N 1.318 -0.764 0 N-CA-C 109.819 -0.437 . . . . 0.0 109.819 -178.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 28.1 m -65.28 -39.21 92.26 Favored 'General case' 0 C--N 1.325 -0.498 0 C-N-CA 123.132 0.573 . . . . 0.0 111.3 179.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 43.1 mtt-85 -57.95 -31.74 67.13 Favored 'General case' 0 C--O 1.217 -0.617 0 O-C-N 121.844 -0.535 . . . . 0.0 110.109 175.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.941 HD22 HG21 ' A' ' 508' ' ' VAL . 4.1 mt -76.62 -31.79 57.63 Favored 'General case' 0 CA--C 1.501 -0.915 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 -175.649 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 -38.89 91.25 Favored 'General case' 0 C--O 1.212 -0.892 0 CA-C-N 115.266 -0.879 . . . . 0.0 109.772 177.386 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 18.1 m -74.9 -15.51 60.7 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.585 0.957 . . . . 0.0 113.585 178.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.7 mtt-85 -98.17 -7.0 30.25 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 179.021 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -122.55 -173.23 14.18 Favored Glycine 0 CA--C 1.507 -0.421 0 CA-C-O 119.674 -0.514 . . . . 0.0 112.702 -174.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 1.2 m . . . . . 0 C--O 1.256 1.42 0 CA-C-O 116.005 -1.95 . . . . 0.0 107.1 -177.336 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.499 1.982 0 CA-C-O 118.635 -0.697 . . . . 0.0 109.436 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -63.0 -36.58 84.04 Favored 'General case' 0 N--CA 1.469 0.48 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 175.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 25.0 m -100.74 147.04 33.1 Favored Pre-proline 0 C--O 1.244 0.81 0 N-CA-C 105.519 -2.03 . . . . 0.0 105.519 172.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -67.03 151.38 82.02 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 118.395 -0.603 . . . . 0.0 113.261 179.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 5.5 m -74.1 166.01 24.14 Favored 'General case' 0 C--O 1.219 -0.507 0 CA-C-N 115.791 -0.64 . . . . 0.0 111.181 -179.338 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -53.35 -45.54 56.68 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.956 0 N-CA-C 112.693 0.627 . . . . 0.0 112.693 -178.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -63.51 -33.62 75.98 Favored 'General case' 0 C--N 1.316 -0.855 0 N-CA-C 111.985 0.365 . . . . 0.0 111.985 -178.825 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -70.59 -40.37 73.27 Favored 'General case' 0 C--N 1.325 -0.48 0 N-CA-C 107.711 -1.218 . . . . 0.0 107.711 179.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.2 mtpt -74.1 -31.66 62.9 Favored 'General case' 0 CA--C 1.507 -0.687 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.708 -177.05 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -54.34 -39.24 66.89 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.28 -0.873 . . . . 0.0 109.239 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -53.21 -38.74 63.14 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 111.4 0.148 . . . . 0.0 111.4 -178.686 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 41.9 tttt -67.89 -58.22 4.93 Favored 'General case' 0 C--O 1.219 -0.542 0 C-N-CA 121.078 -0.249 . . . . 0.0 110.332 176.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.63 -46.48 88.87 Favored 'General case' 0 CA--C 1.504 -0.808 0 N-CA-C 113.366 0.876 . . . . 0.0 113.366 -174.414 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.2 t-160 -59.29 -41.15 88.27 Favored 'General case' 0 C--N 1.317 -0.834 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 -179.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 59.5 m -65.64 -39.32 91.29 Favored 'General case' 0 N--CA 1.464 0.261 0 CA-C-N 118.184 0.447 . . . . 0.0 111.46 -179.409 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.476 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 10.9 mm-40 -63.28 -38.03 89.55 Favored 'General case' 0 CA--C 1.506 -0.721 0 C-N-CA 120.817 -0.353 . . . . 0.0 110.92 178.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.63 -43.13 86.74 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.121 0 N-CA-C 107.415 -1.328 . . . . 0.0 107.415 179.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 53.9 mmtt -63.18 -45.6 91.04 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -179.191 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -65.04 -33.1 75.23 Favored 'General case' 0 C--N 1.324 -0.535 0 CA-C-N 116.412 -0.358 . . . . 0.0 110.885 -178.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.78 -18.48 65.39 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 112.706 0.632 . . . . 0.0 112.706 179.385 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 30.9 mt -108.45 12.02 26.51 Favored 'General case' 0 C--N 1.323 -0.563 0 N-CA-C 112.303 0.482 . . . . 0.0 112.303 -177.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 47.3 mttt -55.18 129.18 37.25 Favored 'General case' 0 C--O 1.21 -0.985 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 176.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 53.8 t -62.92 -41.81 94.12 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.725 0 CA-C-O 122.261 1.029 . . . . 0.0 108.638 178.35 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 37.5 t70 -68.51 -26.77 65.62 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.592 -1.64 . . . . 0.0 113.573 -179.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 26.8 m -158.12 73.04 4.02 Favored Pre-proline 0 N--CA 1.473 0.722 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 -176.272 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.21 145.14 34.31 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 115.728 -2.381 . . . . 0.0 112.79 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -137.23 97.78 3.57 Favored 'General case' 0 C--N 1.326 -0.435 0 CA-C-O 121.714 0.769 . . . . 0.0 110.553 -179.329 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.436 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.7 OUTLIER -57.39 -46.57 85.55 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.764 0 N-CA-C 113.085 0.772 . . . . 0.0 113.085 -179.412 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 92.4 mttt -58.42 -32.1 68.35 Favored 'General case' 0 CA--C 1.504 -0.801 0 N-CA-C 109.657 -0.497 . . . . 0.0 109.657 -177.529 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 61.2 ttt180 -71.19 -40.64 71.09 Favored 'General case' 0 C--N 1.321 -0.654 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 -176.767 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.459 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -64.3 -49.43 71.83 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 175.792 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.6 mt -56.84 -43.28 80.94 Favored 'General case' 0 N--CA 1.47 0.526 0 N-CA-C 111.852 0.316 . . . . 0.0 111.852 -176.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.7 t-20 -65.54 -38.07 88.54 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 121.471 0.653 . . . . 0.0 111.795 179.546 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.476 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -66.04 -48.52 70.81 Favored 'General case' 0 C--N 1.322 -0.629 0 CA-C-O 121.818 0.818 . . . . 0.0 109.33 177.935 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.459 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.23 -43.43 82.87 Favored 'General case' 0 N--CA 1.433 -1.316 0 CA-C-N 114.916 -1.038 . . . . 0.0 111.059 178.581 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -60.6 -37.47 81.5 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 119.035 0.834 . . . . 0.0 112.476 -177.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -75.02 -41.45 59.3 Favored 'General case' 0 C--N 1.33 -0.254 0 C-N-CA 119.518 -0.873 . . . . 0.0 108.84 178.806 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.7 -34.01 69.0 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.422 0.629 . . . . 0.0 110.108 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.38 -19.31 66.42 Favored Glycine 0 N--CA 1.452 -0.29 0 N-CA-C 114.915 0.726 . . . . 0.0 114.915 -179.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.7 t -112.41 -13.81 13.35 Favored 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 118.102 0.951 . . . . 0.0 110.925 -178.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -65.72 144.66 56.76 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 178.817 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.441 ' O ' HD13 ' A' ' 512' ' ' ILE . 29.5 tt0 -77.84 84.78 4.14 Favored 'General case' 0 C--O 1.217 -0.627 0 CA-C-O 122.814 1.293 . . . . 0.0 109.561 178.176 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.919 HG21 HD22 ' A' ' 546' ' ' LEU . 27.6 m -97.22 48.11 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-O 122.862 1.315 . . . . 0.0 108.281 -178.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.6 t -66.62 172.75 3.9 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 -178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 22.5 m -49.22 -33.28 12.21 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 113.389 0.885 . . . . 0.0 113.389 -174.275 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -55.44 -44.32 76.22 Favored 'General case' 0 C--N 1.324 -0.511 0 O-C-N 122.323 -0.236 . . . . 0.0 111.442 178.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.441 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -86.13 -42.06 15.59 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.493 0 N-CA-C 109.39 -0.596 . . . . 0.0 109.39 179.049 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.455 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.41 -37.28 80.35 Favored 'General case' 0 C--N 1.318 -0.769 0 N-CA-C 113.04 0.755 . . . . 0.0 113.04 -174.909 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 69.3 mt-30 -67.82 -31.75 71.82 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-N 116.522 -0.308 . . . . 0.0 111.524 -178.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -89.73 -4.71 57.57 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 121.016 -0.273 . . . . 0.0 110.599 178.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 42.6 m-80 -128.48 46.32 2.62 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-O 121.596 0.712 . . . . 0.0 112.24 -179.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 25.7 p -65.59 -25.6 67.47 Favored 'General case' 0 C--N 1.321 -0.634 0 O-C-N 121.455 -0.778 . . . . 0.0 112.257 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -67.71 -29.08 68.24 Favored 'General case' 0 N--CA 1.475 0.784 0 CA-C-O 122.682 1.229 . . . . 0.0 112.405 178.247 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 79.5 t -68.62 -44.74 82.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.891 0 N-CA-C 106.196 -1.779 . . . . 0.0 106.196 179.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.4 t -63.86 -37.41 79.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.93 -35.35 79.82 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-N 116.184 -0.462 . . . . 0.0 110.867 177.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 92.3 m -77.46 -38.85 48.44 Favored 'General case' 0 C--O 1.217 -0.629 0 CA-C-N 118.749 0.704 . . . . 0.0 109.41 -179.335 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.554 HD23 HD11 ' A' ' 526' ' ' ILE . 43.8 mt -58.21 -35.21 71.32 Favored 'General case' 0 C--N 1.321 -0.656 0 CA-C-O 121.06 0.457 . . . . 0.0 111.117 178.685 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -64.5 -29.11 70.15 Favored 'General case' 0 C--N 1.324 -0.516 0 O-C-N 121.923 -0.486 . . . . 0.0 111.486 175.074 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 84.8 mttt -74.29 -42.12 60.07 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.006 0.372 . . . . 0.0 112.006 179.355 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.554 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.84 -22.7 12.88 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.002 0 N-CA-C 114.29 1.218 . . . . 0.0 114.29 -178.047 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.19 -16.87 55.99 Favored 'General case' 0 C--O 1.215 -0.758 0 N-CA-C 112.041 0.385 . . . . 0.0 112.041 176.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.3 ptt180 -118.74 19.34 13.19 Favored 'General case' 0 C--N 1.325 -0.474 0 C-N-CA 123.323 0.649 . . . . 0.0 111.336 178.214 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.4 t80 -67.5 110.75 3.78 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 112.478 0.547 . . . . 0.0 112.478 -176.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -73.82 -30.34 62.65 Favored 'General case' 0 C--O 1.219 -0.504 0 N-CA-C 115.82 1.785 . . . . 0.0 115.82 -176.784 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.1 -41.85 97.12 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 112.388 0.514 . . . . 0.0 112.388 -174.585 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -131.53 109.29 10.16 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 109.687 -0.486 . . . . 0.0 109.687 -178.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 41.1 tptt -54.99 -43.34 73.46 Favored 'General case' 0 C--O 1.207 -1.141 0 CA-C-N 116.447 -0.342 . . . . 0.0 110.97 179.091 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.8 t0 -55.03 -42.76 73.0 Favored 'General case' 0 C--N 1.323 -0.574 0 CA-C-O 120.995 0.426 . . . . 0.0 111.999 -177.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 74.7 t -58.14 -44.46 87.57 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.466 0 N-CA-C 109.633 -0.506 . . . . 0.0 109.633 177.679 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -62.53 -44.61 95.92 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -65.07 -47.16 78.25 Favored 'General case' 0 C--N 1.323 -0.545 0 C-N-CA 120.38 -0.528 . . . . 0.0 112.185 -179.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.0 tptt -68.67 -39.43 80.63 Favored 'General case' 0 C--O 1.221 -0.403 0 C-N-CA 118.83 -1.148 . . . . 0.0 111.295 -179.09 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.5 -40.23 86.39 Favored 'General case' 0 C--O 1.214 -0.802 0 CA-C-O 121.59 0.709 . . . . 0.0 109.113 178.458 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -64.49 -48.95 73.26 Favored 'General case' 0 C--N 1.313 -1.017 0 CA-C-N 114.703 -1.135 . . . . 0.0 113.113 179.181 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.99 -42.74 90.74 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -179.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.7 t -69.45 -52.01 36.71 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.912 0 CA-C-N 115.822 -0.626 . . . . 0.0 111.276 -178.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 49.2 t80 -54.0 -46.07 71.65 Favored 'General case' 0 C--N 1.321 -0.662 0 C-N-CA 122.291 0.236 . . . . 0.0 110.661 -176.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 17.3 m -65.97 -35.28 80.15 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 122.884 0.474 . . . . 0.0 111.026 -179.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 21.8 mtt85 -61.74 -29.69 70.28 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.775 -0.578 . . . . 0.0 110.154 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.919 HD22 HG21 ' A' ' 508' ' ' VAL . 8.6 mt -76.52 -32.13 58.09 Favored 'General case' 0 CA--C 1.496 -1.12 0 N-CA-C 107.88 -1.155 . . . . 0.0 107.88 -175.232 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.05 -28.89 69.92 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-N 114.921 -1.036 . . . . 0.0 111.601 178.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 23.0 m -80.19 -8.73 59.57 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 115.513 -0.767 . . . . 0.0 112.336 176.691 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 65.1 mtt85 -112.48 -23.04 10.52 Favored 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 112.816 0.673 . . . . 0.0 112.816 -179.927 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -167.46 163.21 36.96 Favored Glycine 0 C--O 1.236 0.238 0 N-CA-C 110.424 -1.07 . . . . 0.0 110.424 -179.599 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 8.4 m . . . . . 0 C--O 1.249 1.064 0 N-CA-C 113.611 0.967 . . . . 0.0 113.611 -176.614 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 118.654 -0.688 . . . . 0.0 109.65 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 62.2 178.41 0.13 Allowed 'General case' 0 N--CA 1.473 0.697 0 O-C-N 124.627 1.204 . . . . 0.0 111.064 -176.483 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 19.4 m -133.85 67.63 74.5 Favored Pre-proline 0 C--N 1.325 -0.458 0 CA-C-N 116.263 -0.426 . . . . 0.0 111.676 -179.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.97 148.29 63.36 Favored 'Trans proline' 0 C--O 1.238 0.499 0 C-N-CA 117.323 -1.318 . . . . 0.0 113.433 -179.047 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.0 m -68.78 164.47 21.77 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 115.584 -0.734 . . . . 0.0 111.5 179.901 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.418 HG13 ' HB3' ' A' ' 506' ' ' LEU . 40.1 t -54.16 -47.92 66.53 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.86 0 O-C-N 122.027 -0.421 . . . . 0.0 111.702 179.412 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.411 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.1 pt-20 -61.69 -34.18 75.3 Favored 'General case' 0 C--N 1.318 -0.797 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -178.347 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -68.13 -42.24 80.49 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 122.237 1.018 . . . . 0.0 108.46 179.544 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 56.3 mtpt -71.65 -35.32 70.33 Favored 'General case' 0 C--N 1.321 -0.646 0 CA-C-N 115.156 -0.929 . . . . 0.0 109.469 -177.64 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.452 HD21 HG21 ' A' ' 519' ' ' VAL . 4.6 tt -58.15 -35.38 71.45 Favored 'General case' 0 C--O 1.214 -0.814 0 CA-C-N 114.817 -1.083 . . . . 0.0 109.72 178.408 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -56.7 -42.15 78.62 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 118.966 0.803 . . . . 0.0 109.778 177.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 82.8 tttt -68.37 -53.8 21.51 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.421 -0.512 . . . . 0.0 110.727 178.257 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.38 -46.15 83.69 Favored 'General case' 0 C--O 1.216 -0.678 0 N-CA-C 112.284 0.475 . . . . 0.0 112.284 -178.234 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.46 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.3 t-160 -58.09 -44.72 87.76 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 109.108 -0.701 . . . . 0.0 109.108 179.57 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.7 m -63.14 -38.22 90.31 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 111.802 0.297 . . . . 0.0 111.802 -179.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.437 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.3 mm-40 -64.66 -37.43 87.54 Favored 'General case' 0 CA--C 1.504 -0.812 0 C-N-CA 120.592 -0.443 . . . . 0.0 110.43 178.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.1 mt -58.92 -43.42 88.56 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.959 0 N-CA-C 106.597 -1.631 . . . . 0.0 106.597 178.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.7 mmtt -63.66 -42.14 98.12 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 112.776 0.658 . . . . 0.0 112.776 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 36.8 m-85 -66.95 -34.69 78.32 Favored 'General case' 0 C--O 1.22 -0.497 0 CA-C-O 120.788 0.327 . . . . 0.0 110.583 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -16.12 63.94 Favored 'General case' 0 C--N 1.32 -0.686 0 N-CA-C 112.589 0.588 . . . . 0.0 112.589 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 36.4 mt -111.94 12.08 20.72 Favored 'General case' 0 C--N 1.323 -0.58 0 N-CA-C 112.009 0.374 . . . . 0.0 112.009 -178.024 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt -58.56 133.24 55.66 Favored 'General case' 0 CA--C 1.489 -1.379 0 N-CA-C 106.829 -1.545 . . . . 0.0 106.829 177.292 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 15.7 m -69.23 -16.13 20.39 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.98 0 CA-C-N 114.448 -1.251 . . . . 0.0 110.022 177.682 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -91.89 -23.53 19.6 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 115.365 -0.834 . . . . 0.0 110.949 -178.365 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 50.6 m -161.15 73.55 2.62 Favored Pre-proline 0 N--CA 1.469 0.494 0 N-CA-C 112.663 0.616 . . . . 0.0 112.663 -175.577 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -73.35 142.55 33.65 Favored 'Trans proline' 0 CA--C 1.533 0.438 0 C-N-CA 113.822 -3.652 . . . . 0.0 112.381 178.388 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.4 t0 -137.36 101.86 4.63 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.589 0.709 . . . . 0.0 110.532 179.718 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.452 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.4 OUTLIER -57.54 -45.4 86.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.746 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -179.015 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 13.2 pttt -59.53 -32.32 70.2 Favored 'General case' 0 CA--C 1.503 -0.851 0 CA-C-O 121.718 0.77 . . . . 0.0 109.605 -176.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.3 ttt180 -71.53 -39.63 70.6 Favored 'General case' 0 C--N 1.318 -0.783 0 CA-C-N 114.794 -1.094 . . . . 0.0 109.064 -176.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.425 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -66.71 -49.15 66.97 Favored 'General case' 0 C--O 1.217 -0.628 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 175.889 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 91.4 mt -56.9 -43.3 81.21 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 111.519 0.192 . . . . 0.0 111.519 -176.839 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -65.89 -33.23 75.35 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.418 0.628 . . . . 0.0 112.204 -179.524 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.437 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -72.62 -47.06 50.9 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.671 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.425 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.53 -45.87 80.9 Favored 'General case' 0 N--CA 1.433 -1.302 0 CA-C-N 115.17 -0.923 . . . . 0.0 111.439 179.434 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -60.46 -36.32 77.97 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 119.063 0.847 . . . . 0.0 112.688 -176.67 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.36 -47.32 43.23 Favored 'General case' 0 C--O 1.223 -0.341 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 178.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -56.76 -35.01 68.14 Favored 'General case' 0 CA--C 1.538 0.515 0 CA-C-O 121.183 0.516 . . . . 0.0 110.768 -178.372 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.75 -18.05 69.88 Favored Glycine 0 C--O 1.241 0.592 0 N-CA-C 115.156 0.822 . . . . 0.0 115.156 179.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.0 t -108.63 -14.16 14.68 Favored 'General case' 0 C--N 1.327 -0.408 0 CA-C-N 117.554 0.677 . . . . 0.0 110.059 -178.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.418 ' HB3' HG13 ' A' ' 471' ' ' VAL . 3.4 mt -67.82 148.49 51.13 Favored 'General case' 0 C--N 1.328 -0.363 0 N-CA-C 109.919 -0.4 . . . . 0.0 109.919 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.417 ' O ' HD13 ' A' ' 512' ' ' ILE . 32.1 tt0 -79.09 84.25 5.1 Favored 'General case' 0 C--O 1.218 -0.583 0 CA-C-O 122.734 1.254 . . . . 0.0 108.785 177.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.959 HG21 HD22 ' A' ' 546' ' ' LEU . 30.3 m -98.92 49.14 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.353 0 CA-C-O 123.133 1.444 . . . . 0.0 107.527 -178.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.4 t -67.1 173.15 3.94 Favored 'General case' 0 C--N 1.315 -0.906 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 -179.107 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 34.4 m -49.32 -32.37 10.99 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 113.766 1.024 . . . . 0.0 113.766 -174.055 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.0 tt0 -55.53 -44.46 76.72 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 111.681 0.252 . . . . 0.0 111.681 177.698 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.417 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -88.05 -42.52 15.01 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 CA-C-O 121.62 0.724 . . . . 0.0 109.264 -179.152 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.477 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.48 -40.08 81.76 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 113.387 0.884 . . . . 0.0 113.387 -175.396 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -70.21 -31.05 68.32 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.191 -177.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -88.65 -7.85 55.64 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 120.998 -0.281 . . . . 0.0 111.397 178.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -126.29 40.85 3.64 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-O 121.564 0.697 . . . . 0.0 111.745 -178.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 11.6 p -62.66 -24.02 67.41 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 113.488 0.921 . . . . 0.0 113.488 -179.144 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.4 -31.09 72.15 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-O 121.557 0.694 . . . . 0.0 112.102 177.832 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.46 HG22 ' CG ' ' A' ' 479' ' ' HIS . 24.3 t -70.92 -41.99 77.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.608 0 N-CA-C 107.462 -1.31 . . . . 0.0 107.462 179.033 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 38.3 t -62.91 -38.46 81.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.48 -32.59 74.29 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.098 -0.501 . . . . 0.0 110.613 177.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.4 m -79.68 -39.38 31.46 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 109.873 -0.417 . . . . 0.0 109.873 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.479 HD23 HD11 ' A' ' 526' ' ' ILE . 37.1 mt -58.27 -35.65 72.1 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-O 121.199 0.523 . . . . 0.0 111.069 179.228 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.5 mtmt -63.52 -29.09 70.41 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 122.117 -0.365 . . . . 0.0 111.412 175.413 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -74.07 -44.3 54.61 Favored 'General case' 0 N--CA 1.475 0.805 0 O-C-N 122.318 -0.239 . . . . 0.0 111.637 178.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.479 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -78.81 -19.96 13.02 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.926 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -176.997 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.86 -13.44 44.95 Favored 'General case' 0 C--O 1.212 -0.896 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 176.542 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.0 ptm180 -120.88 19.38 11.74 Favored 'General case' 0 N--CA 1.47 0.549 0 C-N-CA 122.999 0.52 . . . . 0.0 111.505 176.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.8 t80 -64.98 118.82 9.66 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-O 121.111 0.482 . . . . 0.0 112.183 -177.043 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.7 mttt -83.79 -29.7 27.18 Favored 'General case' 0 C--O 1.218 -0.553 0 N-CA-C 115.915 1.82 . . . . 0.0 115.915 -177.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.06 -41.12 99.39 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-O 121.32 0.581 . . . . 0.0 111.488 -174.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.9 m120 -132.9 111.61 11.2 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 -179.41 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 13.1 tttt -60.32 -36.53 78.13 Favored 'General case' 0 C--O 1.21 -0.993 0 C-N-CA 121.006 -0.278 . . . . 0.0 110.793 -179.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -57.1 -42.3 80.52 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.241 0.543 . . . . 0.0 112.138 -178.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.4 t -58.5 -43.08 86.13 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 N-CA-C 109.198 -0.667 . . . . 0.0 109.198 178.117 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 5.3 ttp -64.8 -40.82 95.86 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 110.453 -0.203 . . . . 0.0 110.453 179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -63.87 -51.55 64.06 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 179.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.4 tptt -70.34 -38.79 74.91 Favored 'General case' 0 C--O 1.219 -0.544 0 C-N-CA 119.289 -0.964 . . . . 0.0 111.751 -177.729 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.79 -39.4 80.96 Favored 'General case' 0 C--O 1.212 -0.878 0 N-CA-C 108.862 -0.792 . . . . 0.0 108.862 178.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.421 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.71 -48.77 70.87 Favored 'General case' 0 C--N 1.315 -0.931 0 CA-C-N 114.988 -1.005 . . . . 0.0 113.518 178.713 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.53 -42.25 91.87 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 108.484 -0.932 . . . . 0.0 108.484 179.803 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.1 t -70.4 -50.29 47.08 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.011 0 CA-C-N 116.108 -0.496 . . . . 0.0 111.452 -178.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 63.5 t80 -55.93 -44.97 78.84 Favored 'General case' 0 C--N 1.319 -0.755 0 CA-C-O 120.643 0.258 . . . . 0.0 110.36 -177.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 19.1 m -67.63 -33.64 75.37 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 121.339 0.59 . . . . 0.0 110.954 179.367 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 10.9 mtt85 -61.44 -28.52 69.33 Favored 'General case' 0 C--O 1.218 -0.587 0 O-C-N 121.78 -0.575 . . . . 0.0 109.932 175.069 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.959 HD22 HG21 ' A' ' 508' ' ' VAL . 11.0 mt -76.68 -35.22 58.06 Favored 'General case' 0 C--O 1.21 -0.976 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 -175.549 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.94 -27.74 69.35 Favored 'General case' 0 C--O 1.215 -0.737 0 CA-C-N 114.751 -1.113 . . . . 0.0 111.395 177.939 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.1 m -81.53 -8.77 59.76 Favored 'General case' 0 C--N 1.316 -0.885 0 CA-C-N 114.693 -1.14 . . . . 0.0 111.739 177.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 89.4 mtt-85 -113.8 -24.41 9.15 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 112.641 0.608 . . . . 0.0 112.641 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -162.62 165.73 36.36 Favored Glycine 0 N--CA 1.452 -0.286 0 N-CA-C 111.827 -0.509 . . . . 0.0 111.827 -178.108 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 7.5 m . . . . . 0 C--O 1.247 0.969 0 CA-C-O 118.68 -0.676 . . . . 0.0 112.712 -177.043 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -77.02 171.82 14.19 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 107.459 -1.312 . . . . 0.0 107.459 176.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 26.8 p -71.28 144.95 90.19 Favored Pre-proline 0 C--N 1.324 -0.535 0 N-CA-C 107.078 -1.453 . . . . 0.0 107.078 176.37 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 70.6 Cg_endo -67.98 146.24 70.55 Favored 'Trans proline' 0 C--O 1.237 0.471 0 C-N-CA 117.376 -1.283 . . . . 0.0 114.239 -178.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.7 m -71.17 167.0 20.3 Favored 'General case' 0 C--N 1.324 -0.529 0 CA-C-N 115.188 -0.914 . . . . 0.0 111.335 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.416 HG13 ' HB3' ' A' ' 506' ' ' LEU . 25.7 t -53.18 -48.63 54.12 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.073 0 N-CA-C 112.551 0.574 . . . . 0.0 112.551 -179.568 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -63.88 -34.09 77.16 Favored 'General case' 0 C--N 1.316 -0.88 0 N-CA-C 112.34 0.496 . . . . 0.0 112.34 -178.698 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -66.17 -39.57 89.85 Favored 'General case' 0 C--N 1.324 -0.536 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -74.33 -35.87 63.63 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-N 115.07 -0.968 . . . . 0.0 110.03 -178.192 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.496 HD21 HG21 ' A' ' 519' ' ' VAL . 5.3 tt -59.03 -35.51 73.43 Favored 'General case' 0 C--O 1.213 -0.84 0 CA-C-N 115.002 -0.999 . . . . 0.0 109.531 177.737 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -56.38 -41.03 75.57 Favored 'General case' 0 C--N 1.326 -0.415 0 N-CA-C 109.437 -0.579 . . . . 0.0 109.437 178.287 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 83.4 tttt -69.64 -53.22 19.76 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 177.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.43 -46.35 83.65 Favored 'General case' 0 C--O 1.216 -0.708 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -178.015 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.9 t-160 -59.39 -41.82 90.26 Favored 'General case' 0 C--N 1.32 -0.7 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 -179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.6 m -64.66 -41.16 96.28 Favored 'General case' 0 C--O 1.222 -0.362 0 C-N-CA 121.234 -0.186 . . . . 0.0 111.289 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.472 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 16.3 mm-40 -62.79 -41.94 99.49 Favored 'General case' 0 CA--C 1.503 -0.841 0 CA-C-N 117.964 0.347 . . . . 0.0 110.648 178.245 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.93 -46.9 76.48 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.206 0 N-CA-C 107.784 -1.191 . . . . 0.0 107.784 177.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.8 mtpt -67.47 -37.52 83.04 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 112.812 0.671 . . . . 0.0 112.812 -176.765 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -67.41 -32.61 73.62 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.77 0.319 . . . . 0.0 110.265 177.768 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.34 -17.8 64.9 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 179.171 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 31.6 mt -105.84 12.06 31.18 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.224 0.453 . . . . 0.0 112.224 -178.801 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 2.9 mttt -54.81 129.01 35.56 Favored 'General case' 0 C--O 1.209 -1.074 0 N-CA-C 106.729 -1.582 . . . . 0.0 106.729 176.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.27 -40.46 89.14 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.804 0 CA-C-O 122.809 1.29 . . . . 0.0 107.852 176.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -65.12 -28.48 69.46 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 112.81 -1.996 . . . . 0.0 113.441 -179.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 69.5 m -162.26 75.45 2.17 Favored Pre-proline 0 N--CA 1.474 0.73 0 N-CA-C 112.39 0.515 . . . . 0.0 112.39 -177.668 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -73.5 143.75 35.01 Favored 'Trans proline' 0 CA--C 1.532 0.402 0 C-N-CA 114.741 -3.039 . . . . 0.0 112.605 179.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 67.7 t0 -137.21 100.91 4.39 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.398 0.618 . . . . 0.0 110.09 -178.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -59.5 -46.72 92.64 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.891 0 N-CA-C 113.051 0.76 . . . . 0.0 113.051 -178.242 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 62.3 mttm -57.11 -32.06 65.92 Favored 'General case' 0 CA--C 1.508 -0.656 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -178.458 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 -69.9 -40.43 75.63 Favored 'General case' 0 C--N 1.321 -0.639 0 C-N-CA 119.868 -0.733 . . . . 0.0 109.162 -177.418 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.421 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.01 -48.33 74.3 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 109.021 -0.733 . . . . 0.0 109.021 176.033 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.1 mt -56.96 -44.38 82.55 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 117.944 0.338 . . . . 0.0 111.855 -176.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 23.2 t30 -61.6 -38.92 89.35 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-O 121.797 0.808 . . . . 0.0 111.541 179.203 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.472 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.72 -48.55 59.11 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 121.5 0.667 . . . . 0.0 109.791 178.155 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.421 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.44 -48.51 71.62 Favored 'General case' 0 N--CA 1.43 -1.45 0 CA-C-N 115.341 -0.845 . . . . 0.0 111.162 178.708 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -61.99 -35.82 79.65 Favored 'General case' 0 C--N 1.322 -0.613 0 N-CA-C 113.313 0.857 . . . . 0.0 113.313 -175.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -46.73 61.68 Favored 'General case' 0 C--O 1.225 -0.232 0 N-CA-C 107.94 -1.133 . . . . 0.0 107.94 176.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -57.04 -34.27 68.05 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 121.368 0.604 . . . . 0.0 110.247 -178.628 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.17 -17.47 68.08 Favored Glycine 0 C--O 1.241 0.533 0 N-CA-C 115.101 0.801 . . . . 0.0 115.101 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.8 t -110.99 -12.06 14.26 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 117.867 0.834 . . . . 0.0 110.081 -179.5 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.416 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.1 mt -69.63 147.48 50.61 Favored 'General case' 0 C--N 1.327 -0.386 0 O-C-N 121.917 -0.489 . . . . 0.0 110.057 179.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.414 ' O ' HD13 ' A' ' 512' ' ' ILE . 36.1 tt0 -78.73 84.48 4.81 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-O 122.83 1.3 . . . . 0.0 108.965 177.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.892 HG21 HD22 ' A' ' 546' ' ' LEU . 28.4 m -99.05 46.32 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.291 0 N-CA-C 106.846 -1.538 . . . . 0.0 106.846 -179.397 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.1 t -66.16 169.69 6.73 Favored 'General case' 0 C--N 1.316 -0.888 0 N-CA-C 106.576 -1.639 . . . . 0.0 106.576 -177.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 22.9 m -49.29 -29.4 5.88 Favored 'General case' 0 C--O 1.219 -0.545 0 N-CA-C 114.266 1.209 . . . . 0.0 114.266 -174.179 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -55.62 -47.53 76.42 Favored 'General case' 0 CA--C 1.541 0.628 0 O-C-N 122.309 -0.244 . . . . 0.0 111.322 175.63 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.414 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -86.03 -39.84 13.95 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.4 0 CA-C-O 121.424 0.63 . . . . 0.0 109.513 179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.442 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.92 -36.53 77.2 Favored 'General case' 0 N--CA 1.438 -1.039 0 N-CA-C 113.226 0.824 . . . . 0.0 113.226 -175.658 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -66.64 -32.94 74.59 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.786 0.803 . . . . 0.0 111.384 -178.404 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 11.7 ptmm? -92.5 -1.13 57.18 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-N 114.997 -1.002 . . . . 0.0 111.753 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -132.29 43.25 3.03 Favored 'General case' 0 CA--C 1.536 0.437 0 CA-C-O 121.663 0.744 . . . . 0.0 112.457 178.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 21.2 p -64.44 -25.57 68.06 Favored 'General case' 0 C--N 1.323 -0.555 0 N-CA-C 112.587 0.588 . . . . 0.0 112.587 -179.276 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.14 -32.2 73.67 Favored 'General case' 0 C--N 1.325 -0.479 0 CA-C-O 121.725 0.774 . . . . 0.0 112.354 178.618 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.496 HG21 HD21 ' A' ' 475' ' ' LEU . 61.5 t -68.39 -41.34 83.39 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.739 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 178.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.6 t -63.39 -37.01 78.39 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 178.417 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.72 -38.22 89.63 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.476 -0.329 . . . . 0.0 110.535 177.472 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 99.2 m -74.85 -38.11 62.06 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 118.5 0.591 . . . . 0.0 110.455 -179.836 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.689 HD23 HD11 ' A' ' 526' ' ' ILE . 65.1 mt -58.82 -34.15 71.2 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-O 120.98 0.419 . . . . 0.0 111.034 178.21 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.7 mtmt -65.08 -29.19 70.05 Favored 'General case' 0 CA--C 1.537 0.455 0 O-C-N 121.755 -0.59 . . . . 0.0 111.26 175.262 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -73.14 -42.73 62.54 Favored 'General case' 0 N--CA 1.472 0.655 0 O-C-N 122.239 -0.288 . . . . 0.0 111.441 179.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.689 HD11 HD23 ' A' ' 523' ' ' LEU . 2.2 pt -78.87 -24.13 13.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.04 0 N-CA-C 114.463 1.283 . . . . 0.0 114.463 -178.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.423 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -62.59 -14.09 38.72 Favored 'General case' 0 C--O 1.213 -0.833 0 O-C-N 121.736 -0.602 . . . . 0.0 112.187 176.611 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 36.2 ptt180 -118.72 18.69 13.35 Favored 'General case' 0 N--CA 1.474 0.744 0 C-N-CA 123.357 0.663 . . . . 0.0 111.516 176.902 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -68.74 106.26 2.59 Favored 'General case' 0 C--N 1.325 -0.485 0 N-CA-C 112.916 0.71 . . . . 0.0 112.916 -175.736 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.0 mttt -75.97 -23.23 55.33 Favored 'General case' 0 C--O 1.218 -0.575 0 N-CA-C 114.031 1.123 . . . . 0.0 114.031 -179.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.54 -24.4 64.63 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 112.099 0.407 . . . . 0.0 112.099 -177.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.9 t-20 -151.67 126.18 9.47 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 120.511 -0.475 . . . . 0.0 112.062 174.357 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 46.4 tptt -62.21 -50.13 73.0 Favored 'General case' 0 C--O 1.209 -1.076 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.408 -178.425 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -57.82 -39.82 78.53 Favored 'General case' 0 C--N 1.323 -0.546 0 CA-C-O 121.251 0.548 . . . . 0.0 111.455 -174.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 54.8 t -56.1 -45.36 80.6 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 109.947 -0.39 . . . . 0.0 109.947 176.829 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.8 ttp -67.41 -43.41 81.35 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-O 119.413 -0.327 . . . . 0.0 110.542 -179.839 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.1 mm-40 -64.24 -47.64 78.89 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 112.469 0.544 . . . . 0.0 112.469 179.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.0 tptt -69.48 -37.94 77.47 Favored 'General case' 0 C--O 1.222 -0.393 0 C-N-CA 119.198 -1.001 . . . . 0.0 110.669 -179.337 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . 0.419 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -58.82 -41.57 87.17 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 178.128 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.423 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.27 -51.09 67.57 Favored 'General case' 0 C--N 1.313 -0.986 0 CA-C-N 114.599 -1.182 . . . . 0.0 113.322 179.479 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.71 -44.71 90.47 Favored 'General case' 0 C--N 1.319 -0.743 0 N-CA-C 108.193 -1.04 . . . . 0.0 108.193 -179.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.5 t -67.75 -50.0 64.45 Favored 'Isoleucine or valine' 0 CA--C 1.499 -0.998 0 CA-C-N 116.142 -0.481 . . . . 0.0 111.179 -177.086 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -54.58 -44.58 73.12 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 109.489 -0.56 . . . . 0.0 109.489 -179.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.6 m -65.46 -39.04 91.54 Favored 'General case' 0 C--N 1.322 -0.615 0 C-N-CA 122.925 0.49 . . . . 0.0 111.317 179.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 35.8 mtt-85 -57.74 -31.74 66.76 Favored 'General case' 0 C--N 1.327 -0.411 0 O-C-N 121.874 -0.516 . . . . 0.0 110.447 175.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.892 HD22 HG21 ' A' ' 508' ' ' VAL . 3.3 mt -76.69 -31.7 57.4 Favored 'General case' 0 CA--C 1.502 -0.9 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 -176.645 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.94 -37.83 88.62 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 115.349 -0.841 . . . . 0.0 109.45 178.267 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.2 m -70.2 -8.94 53.97 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.39 0.885 . . . . 0.0 113.39 177.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 77.0 mtt85 -113.25 9.37 18.36 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 122.562 0.345 . . . . 0.0 110.129 177.606 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -94.8 -170.07 36.97 Favored Glycine 0 C--O 1.226 -0.401 0 C-N-CA 121.349 -0.453 . . . . 0.0 112.772 -176.356 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 C--O 1.243 0.738 0 C-N-CA 124.244 1.017 . . . . 0.0 111.833 -178.984 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.029 0 CA-C-O 118.751 -0.643 . . . . 0.0 109.427 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -62.41 -34.67 77.19 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 107.188 -1.412 . . . . 0.0 107.188 175.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 29.9 m -104.57 145.1 30.05 Favored Pre-proline 0 C--O 1.244 0.787 0 N-CA-C 105.141 -2.17 . . . . 0.0 105.141 171.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -67.51 154.24 74.23 Favored 'Trans proline' 0 CA--C 1.533 0.453 0 O-C-N 122.213 0.586 . . . . 0.0 112.901 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.8 m -72.68 165.44 24.76 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.044 -0.525 . . . . 0.0 111.419 -178.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.411 HG13 ' HB3' ' A' ' 506' ' ' LEU . 51.8 t -54.31 -47.55 68.82 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.947 0 N-CA-C 112.671 0.619 . . . . 0.0 112.671 -178.874 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.433 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.7 pt-20 -63.38 -33.9 76.56 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 122.525 0.33 . . . . 0.0 111.781 -178.655 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.9 mt-10 -68.36 -41.56 80.45 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 178.413 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -72.74 -32.72 65.89 Favored 'General case' 0 CA--C 1.506 -0.712 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.842 -176.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.445 HD23 HD21 ' A' ' 503' ' ' LEU . 1.2 tm? -56.35 -35.61 67.85 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.698 179.259 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -54.7 -39.95 68.68 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 120.427 -0.509 . . . . 0.0 110.952 -179.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 39.1 tttt -66.46 -54.3 25.68 Favored 'General case' 0 N--CA 1.469 0.511 0 N-CA-C 109.97 -0.381 . . . . 0.0 109.97 176.569 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.25 -47.36 85.66 Favored 'General case' 0 C--O 1.214 -0.774 0 N-CA-C 113.47 0.915 . . . . 0.0 113.47 -176.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.7 t-160 -61.01 -40.57 94.06 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.261 -0.644 . . . . 0.0 109.261 -179.597 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 66.1 m -64.04 -41.93 97.24 Favored 'General case' 0 C--N 1.328 -0.355 0 C-N-CA 120.495 -0.482 . . . . 0.0 110.424 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -63.91 -42.69 97.35 Favored 'General case' 0 CA--C 1.5 -0.979 0 CA-C-O 119.426 -0.321 . . . . 0.0 111.349 178.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.43 -46.44 70.48 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.272 0 N-CA-C 107.991 -1.114 . . . . 0.0 107.991 177.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 47.1 mtpt -68.09 -38.42 82.33 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 113.19 0.811 . . . . 0.0 113.19 -176.858 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -68.37 -31.19 70.4 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 120.709 0.29 . . . . 0.0 110.245 177.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -19.17 65.71 Favored 'General case' 0 C--N 1.322 -0.61 0 N-CA-C 112.178 0.436 . . . . 0.0 112.178 178.635 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.5 mt -105.84 12.15 31.1 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.562 0.579 . . . . 0.0 112.562 -178.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 74.7 mttt -55.62 129.41 38.96 Favored 'General case' 0 C--O 1.209 -1.038 0 N-CA-C 106.809 -1.552 . . . . 0.0 106.809 177.218 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.7 t -63.15 -40.64 89.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.745 0 CA-C-O 122.363 1.078 . . . . 0.0 108.504 178.005 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.7 t70 -68.43 -27.14 65.92 Favored 'General case' 0 C--N 1.319 -0.758 0 CA-C-N 113.491 -1.686 . . . . 0.0 113.148 -178.566 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 49.4 m -159.43 74.0 3.29 Favored Pre-proline 0 N--CA 1.47 0.563 0 N-CA-C 112.752 0.649 . . . . 0.0 112.752 -176.495 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 96.5 Cg_endo -72.45 145.93 43.59 Favored 'Trans proline' 0 CA--C 1.532 0.417 0 C-N-CA 114.701 -3.066 . . . . 0.0 112.372 179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -137.3 91.74 2.64 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.523 0.678 . . . . 0.0 110.154 -176.015 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.414 HG12 ' H ' ' A' ' 493' ' ' VAL . 1.1 p -57.37 -46.02 85.43 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.751 0 N-CA-C 113.899 1.074 . . . . 0.0 113.899 -177.462 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 90.2 mttt -58.06 -31.36 66.98 Favored 'General case' 0 CA--C 1.507 -0.694 0 CA-C-O 120.843 0.354 . . . . 0.0 110.089 -177.889 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 63.1 ttm-85 -70.9 -42.08 70.42 Favored 'General case' 0 C--N 1.32 -0.705 0 N-CA-C 109.457 -0.571 . . . . 0.0 109.457 -177.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.486 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -63.26 -49.44 74.09 Favored 'General case' 0 C--O 1.213 -0.841 0 N-CA-C 108.183 -1.043 . . . . 0.0 108.183 176.602 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 80.8 mt -57.01 -42.89 81.2 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 111.944 0.35 . . . . 0.0 111.944 -176.383 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.0 t-20 -66.01 -38.35 88.24 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 121.297 0.57 . . . . 0.0 111.468 179.396 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -65.77 -48.25 72.45 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 121.658 0.742 . . . . 0.0 109.22 177.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.486 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.76 -44.52 81.85 Favored 'General case' 0 N--CA 1.433 -1.309 0 CA-C-N 115.338 -0.846 . . . . 0.0 111.552 177.425 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 2.4 pt-20 -62.41 -36.97 84.0 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 119.161 0.891 . . . . 0.0 112.32 -177.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -71.77 -43.92 64.9 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.337 -0.986 . . . . 0.0 108.337 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.445 HD21 HD23 ' A' ' 475' ' ' LEU . 0.8 OUTLIER -60.8 -31.71 71.09 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-O 121.399 0.619 . . . . 0.0 110.246 -179.111 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.82 -17.41 62.84 Favored Glycine 0 C--O 1.24 0.517 0 CA-C-O 119.507 -0.607 . . . . 0.0 114.494 179.399 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 12.2 t -114.85 -13.36 11.99 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 117.742 0.771 . . . . 0.0 111.048 -179.416 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.411 ' HB3' HG13 ' A' ' 471' ' ' VAL . 2.2 mt -67.0 146.41 54.39 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 109.386 -0.598 . . . . 0.0 109.386 179.197 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.439 ' O ' HD13 ' A' ' 512' ' ' ILE . 35.5 tt0 -77.67 84.22 4.02 Favored 'General case' 0 C--O 1.216 -0.696 0 CA-C-O 122.515 1.15 . . . . 0.0 110.17 178.476 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.892 HG21 HD22 ' A' ' 546' ' ' LEU . 26.9 m -98.27 47.56 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.301 0 CA-C-O 122.942 1.353 . . . . 0.0 109.079 -178.398 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.2 t -66.94 173.61 3.53 Favored 'General case' 0 C--N 1.317 -0.826 0 N-CA-C 107.334 -1.358 . . . . 0.0 107.334 -178.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 20.1 m -49.38 -32.99 12.61 Favored 'General case' 0 C--O 1.214 -0.794 0 N-CA-C 113.711 1.004 . . . . 0.0 113.711 -173.939 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -55.44 -43.9 75.8 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 111.853 0.316 . . . . 0.0 111.853 177.612 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.439 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -87.14 -41.85 14.94 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.546 0 CA-C-O 121.518 0.675 . . . . 0.0 109.32 179.46 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.455 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.92 -38.08 81.32 Favored 'General case' 0 C--N 1.318 -0.795 0 N-CA-C 112.919 0.711 . . . . 0.0 112.919 -174.64 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 90.2 mt-30 -67.62 -32.91 73.94 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.716 -178.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -88.69 -7.38 56.42 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 120.69 -0.404 . . . . 0.0 110.671 179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -123.49 40.58 3.69 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-O 121.122 0.487 . . . . 0.0 111.017 -177.484 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 12.0 p -62.63 -29.53 70.69 Favored 'General case' 0 C--N 1.324 -0.536 0 O-C-N 121.638 -0.664 . . . . 0.0 112.766 -179.283 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 -63.17 -29.21 70.61 Favored 'General case' 0 N--CA 1.474 0.727 0 CA-C-O 121.527 0.68 . . . . 0.0 111.633 177.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.402 HG21 HD21 ' A' ' 475' ' ' LEU . 46.9 t -71.45 -43.79 72.16 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.704 0 N-CA-C 107.816 -1.179 . . . . 0.0 107.816 -179.929 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 43.1 t -61.95 -39.99 85.61 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.563 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 179.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -61.46 -35.02 76.44 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 116.116 -0.493 . . . . 0.0 111.293 177.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.8 m -77.57 -38.55 48.17 Favored 'General case' 0 C--O 1.218 -0.598 0 CA-C-N 118.883 0.765 . . . . 0.0 109.939 179.018 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.704 HD23 HD11 ' A' ' 526' ' ' ILE . 55.1 mt -58.66 -34.32 71.09 Favored 'General case' 0 C--N 1.321 -0.662 0 CA-C-O 121.148 0.499 . . . . 0.0 110.208 177.443 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 5.4 mtpp -61.73 -34.36 75.68 Favored 'General case' 0 C--N 1.325 -0.458 0 O-C-N 122.008 -0.432 . . . . 0.0 111.66 174.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 73.2 mttt -69.71 -45.51 68.08 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.728 0.299 . . . . 0.0 111.769 179.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.704 HD11 HD23 ' A' ' 523' ' ' LEU . 3.9 pt -78.42 -22.59 13.29 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.765 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -175.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.469 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -64.36 -12.28 40.82 Favored 'General case' 0 C--N 1.32 -0.68 0 O-C-N 121.903 -0.498 . . . . 0.0 112.168 175.367 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.3 ptm180 -121.38 18.95 11.39 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 122.604 0.361 . . . . 0.0 111.51 175.121 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -67.92 118.4 11.07 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 111.899 0.333 . . . . 0.0 111.899 -176.789 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -85.19 -26.15 26.94 Favored 'General case' 0 C--O 1.219 -0.549 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -177.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.63 -41.59 98.24 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.174 0.511 . . . . 0.0 111.367 -175.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.9 m120 -130.93 109.92 10.89 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-N 116.222 -0.445 . . . . 0.0 109.82 -179.102 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -58.18 -39.31 78.61 Favored 'General case' 0 C--O 1.202 -1.413 0 CA-C-N 116.494 -0.321 . . . . 0.0 110.801 178.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.1 t0 -56.54 -42.79 79.09 Favored 'General case' 0 C--N 1.32 -0.697 0 CA-C-O 121.385 0.612 . . . . 0.0 111.262 -178.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 69.0 t -59.89 -44.06 93.5 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.489 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 177.801 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 29.3 ttm -57.98 -48.01 81.28 Favored 'General case' 0 CA--C 1.505 -0.751 0 C-N-CA 122.61 0.364 . . . . 0.0 110.4 179.13 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.68 -47.15 76.42 Favored 'General case' 0 C--N 1.315 -0.912 0 N-CA-C 112.61 0.596 . . . . 0.0 112.61 -179.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -72.12 -37.31 69.5 Favored 'General case' 0 CA--C 1.513 -0.468 0 C-N-CA 118.148 -1.421 . . . . 0.0 110.778 -176.224 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . 0.405 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -59.11 -40.87 86.68 Favored 'General case' 0 C--O 1.212 -0.914 0 N-CA-C 108.809 -0.811 . . . . 0.0 108.809 178.065 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.4 -49.92 71.89 Favored 'General case' 0 C--N 1.314 -0.969 0 N-CA-C 114.239 1.2 . . . . 0.0 114.239 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -59.04 -43.8 91.69 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 -178.823 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 65.1 t -69.18 -50.06 56.14 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.971 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.493 -176.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -54.31 -44.82 72.34 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 110.11 -0.329 . . . . 0.0 110.11 -178.188 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 23.4 m -66.38 -36.22 82.31 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.914 0.486 . . . . 0.0 111.291 179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 41.1 mtt-85 -60.47 -28.92 68.71 Favored 'General case' 0 C--N 1.325 -0.498 0 O-C-N 121.735 -0.603 . . . . 0.0 110.329 175.387 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.892 HD22 HG21 ' A' ' 508' ' ' VAL . 7.8 mt -76.77 -33.42 58.07 Favored 'General case' 0 CA--C 1.496 -1.116 0 N-CA-C 107.665 -1.235 . . . . 0.0 107.665 -175.07 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.84 -29.64 70.31 Favored 'General case' 0 C--O 1.217 -0.62 0 CA-C-N 114.869 -1.059 . . . . 0.0 111.755 178.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.8 m -79.18 -14.31 59.16 Favored 'General case' 0 C--N 1.317 -0.828 0 CA-C-N 115.789 -0.642 . . . . 0.0 112.173 176.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 71.9 mtt85 -104.54 -23.55 13.12 Favored 'General case' 0 N--CA 1.474 0.748 0 N-CA-C 112.835 0.68 . . . . 0.0 112.835 179.995 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -166.41 161.78 35.45 Favored Glycine 0 N--CA 1.453 -0.179 0 N-CA-C 110.527 -1.029 . . . . 0.0 110.527 -178.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 10.2 m . . . . . 0 C--O 1.249 1.066 0 CA-C-O 118.385 -0.817 . . . . 0.0 112.882 -177.006 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.607 0 N-CA-C 109.694 -0.484 . . . . 0.0 109.694 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -75.17 171.34 14.33 Favored 'General case' 0 C--N 1.326 -0.434 0 N-CA-C 107.093 -1.447 . . . . 0.0 107.093 176.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 24.9 m -69.96 145.14 93.88 Favored Pre-proline 0 C--N 1.323 -0.546 0 N-CA-C 108.319 -0.993 . . . . 0.0 108.319 177.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -68.5 150.87 75.67 Favored 'Trans proline' 0 C--O 1.238 0.524 0 C-N-CA 117.958 -0.895 . . . . 0.0 113.712 -179.38 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 11.9 m -69.82 164.92 22.62 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.379 -0.828 . . . . 0.0 111.618 -179.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.403 HG13 ' HB3' ' A' ' 506' ' ' LEU . 43.1 t -54.65 -48.02 72.15 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.14 0 O-C-N 122.042 -0.411 . . . . 0.0 111.824 179.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -60.25 -34.25 73.44 Favored 'General case' 0 C--N 1.318 -0.772 0 N-CA-C 111.967 0.358 . . . . 0.0 111.967 -178.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -68.77 -42.89 76.85 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-O 122.166 0.984 . . . . 0.0 108.603 179.56 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -72.57 -34.84 67.75 Favored 'General case' 0 CA--C 1.509 -0.613 0 CA-C-N 114.898 -1.046 . . . . 0.0 110.332 -176.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.551 HD21 HG21 ' A' ' 519' ' ' VAL . 2.1 tt -57.0 -40.3 76.33 Favored 'General case' 0 C--O 1.209 -1.07 0 CA-C-N 114.758 -1.11 . . . . 0.0 109.364 179.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -60.35 -37.18 79.87 Favored 'General case' 0 C--N 1.322 -0.623 0 C-N-CA 120.108 -0.637 . . . . 0.0 110.59 -178.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 64.4 tttp -68.72 -53.44 22.06 Favored 'General case' 0 C--O 1.22 -0.488 0 C-N-CA 119.814 -0.754 . . . . 0.0 109.828 176.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.93 -45.33 82.81 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 118.557 0.617 . . . . 0.0 112.191 -179.053 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.426 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.4 t-160 -57.44 -43.78 84.18 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 -179.455 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 48.7 m -64.63 -38.5 91.21 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 111.864 0.32 . . . . 0.0 111.864 179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.422 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 50.5 mm-40 -65.47 -35.8 81.97 Favored 'General case' 0 C--N 1.327 -0.411 0 C-N-CA 119.987 -0.685 . . . . 0.0 110.046 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.4 -42.34 83.86 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.024 0 N-CA-C 107.17 -1.418 . . . . 0.0 107.17 178.426 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 32.5 mmtt -64.16 -45.25 89.29 Favored 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 111.813 0.301 . . . . 0.0 111.813 -179.711 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -65.13 -33.41 75.95 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.272 -178.207 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.83 -18.05 65.07 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.648 0.61 . . . . 0.0 112.648 179.404 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 29.8 mt -108.56 12.08 26.26 Favored 'General case' 0 C--N 1.322 -0.588 0 N-CA-C 112.246 0.462 . . . . 0.0 112.246 -177.537 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 3.5 mtpt -54.49 129.69 36.94 Favored 'General case' 0 C--O 1.211 -0.952 0 N-CA-C 106.611 -1.626 . . . . 0.0 106.611 176.658 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.8 t -62.94 -41.17 91.74 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.742 0 CA-C-O 122.612 1.196 . . . . 0.0 107.819 176.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -65.63 -28.03 68.82 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 113.052 -1.886 . . . . 0.0 113.549 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 5.7 m -159.63 72.7 3.28 Favored Pre-proline 0 N--CA 1.473 0.691 0 N-CA-C 112.837 0.68 . . . . 0.0 112.837 -176.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -73.4 143.01 34.18 Favored 'Trans proline' 0 CA--C 1.532 0.408 0 C-N-CA 114.281 -3.346 . . . . 0.0 112.509 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.4 t0 -137.22 100.44 4.26 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.581 0.705 . . . . 0.0 109.976 -178.155 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.7 -47.88 91.13 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.889 0 N-CA-C 112.883 0.697 . . . . 0.0 112.883 -177.97 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -57.04 -32.05 65.78 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 110.055 -0.35 . . . . 0.0 110.055 -178.218 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 56.9 ttt180 -68.84 -40.25 79.53 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 -177.476 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.4 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.85 -49.81 69.12 Favored 'General case' 0 C--O 1.217 -0.654 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 175.696 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 60.9 mt -56.54 -44.36 80.81 Favored 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 -175.714 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -62.82 -39.95 95.87 Favored 'General case' 0 C--N 1.322 -0.618 0 CA-C-O 121.716 0.769 . . . . 0.0 111.206 -179.419 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.422 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -70.88 -45.68 63.97 Favored 'General case' 0 C--N 1.322 -0.598 0 O-C-N 121.745 -0.597 . . . . 0.0 110.0 179.216 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.4 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.58 -49.51 70.2 Favored 'General case' 0 N--CA 1.427 -1.624 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.594 177.202 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -61.89 -36.06 80.16 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -175.672 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -69.38 -46.44 66.92 Favored 'General case' 0 C--O 1.223 -0.337 0 N-CA-C 107.744 -1.206 . . . . 0.0 107.744 176.693 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.94 -33.64 67.2 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-O 121.498 0.666 . . . . 0.0 109.951 -179.861 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.23 -17.53 68.27 Favored Glycine 0 N--CA 1.452 -0.288 0 N-CA-C 115.115 0.806 . . . . 0.0 115.115 179.439 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.2 t -111.87 -11.44 13.91 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 117.989 0.895 . . . . 0.0 110.241 -179.79 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.403 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.2 mt -69.37 148.67 49.33 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 121.896 -0.503 . . . . 0.0 109.822 179.41 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.443 ' O ' HD13 ' A' ' 512' ' ' ILE . 35.7 tt0 -78.25 84.15 4.47 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-O 122.49 1.138 . . . . 0.0 108.864 177.299 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.926 HG21 HD22 ' A' ' 546' ' ' LEU . 27.2 m -98.55 47.22 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.37 0 CA-C-O 123.21 1.481 . . . . 0.0 107.708 -178.971 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.3 t -66.8 171.93 4.82 Favored 'General case' 0 C--N 1.316 -0.891 0 N-CA-C 106.645 -1.613 . . . . 0.0 106.645 -178.03 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.7 m -49.15 -33.69 12.65 Favored 'General case' 0 C--O 1.213 -0.845 0 N-CA-C 114.112 1.153 . . . . 0.0 114.112 -173.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 53.1 tt0 -55.62 -44.79 77.38 Favored 'General case' 0 CA--C 1.541 0.613 0 N-CA-C 112.188 0.44 . . . . 0.0 112.188 176.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.443 HD13 ' O ' ' A' ' 507' ' ' GLN . 3.9 mp -83.63 -42.48 17.48 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.73 0 CA-C-O 122.036 0.922 . . . . 0.0 108.611 179.461 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.66 -37.7 76.56 Favored 'General case' 0 C--N 1.314 -0.945 0 N-CA-C 113.445 0.906 . . . . 0.0 113.445 -176.26 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -67.11 -33.44 75.47 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.453 -0.34 . . . . 0.0 111.425 -179.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 17.6 ptpt -89.35 -9.74 49.27 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 120.698 -0.401 . . . . 0.0 111.248 179.97 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -125.08 41.7 3.45 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.516 0.674 . . . . 0.0 112.002 -175.973 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 22.8 p -62.24 -27.43 68.99 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 113.51 0.93 . . . . 0.0 113.51 -178.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 -66.95 -26.54 66.88 Favored 'General case' 0 N--CA 1.47 0.532 0 N-CA-C 112.535 0.569 . . . . 0.0 112.535 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.551 HG21 HD21 ' A' ' 475' ' ' LEU . 43.0 t -71.71 -42.26 70.83 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 N-CA-C 106.868 -1.53 . . . . 0.0 106.868 178.037 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.2 t -63.33 -37.35 79.26 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.579 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 178.277 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.57 -34.46 77.86 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 116.351 -0.386 . . . . 0.0 110.872 177.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.1 m -77.27 -39.84 46.72 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-N 118.072 0.396 . . . . 0.0 110.203 179.47 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 526' ' ' ILE . 54.1 mt -58.24 -35.37 71.61 Favored 'General case' 0 C--N 1.32 -0.689 0 CA-C-O 121.082 0.467 . . . . 0.0 110.929 178.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.0 mtmt -63.32 -29.01 70.4 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 122.062 -0.399 . . . . 0.0 111.348 175.219 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -74.58 -42.95 57.83 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 179.048 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.648 HD11 HD23 ' A' ' 523' ' ' LEU . 1.3 pt -78.78 -23.38 13.0 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.01 0 N-CA-C 114.326 1.232 . . . . 0.0 114.326 -177.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.4 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -60.8 -17.13 47.63 Favored 'General case' 0 C--O 1.214 -0.784 0 O-C-N 121.994 -0.442 . . . . 0.0 111.955 176.406 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 32.1 ptt180 -118.68 19.13 13.3 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 123.01 0.524 . . . . 0.0 111.386 177.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.8 t80 -67.07 115.49 6.84 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.083 0.468 . . . . 0.0 111.992 -176.464 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 68.3 mttm -83.78 -21.99 32.0 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 114.736 1.384 . . . . 0.0 114.736 -177.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -70.42 -22.45 62.72 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 120.527 -0.469 . . . . 0.0 112.119 -177.143 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -152.24 126.68 9.36 Favored 'General case' 0 C--N 1.328 -0.329 0 C-N-CA 120.708 -0.397 . . . . 0.0 111.588 175.552 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.8 tptt -64.37 -47.8 77.9 Favored 'General case' 0 C--O 1.209 -1.038 0 CA-C-N 116.094 -0.503 . . . . 0.0 111.555 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -57.75 -39.78 78.19 Favored 'General case' 0 C--N 1.324 -0.506 0 CA-C-O 121.339 0.59 . . . . 0.0 111.347 -174.689 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 59.8 t -55.99 -45.15 80.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.459 0 CA-C-N 116.449 -0.341 . . . . 0.0 110.121 176.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.2 ttp -65.87 -44.08 86.43 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 119.276 -0.392 . . . . 0.0 110.28 179.597 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -65.04 -46.69 80.2 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 112.497 0.554 . . . . 0.0 112.497 -179.266 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -69.43 -38.95 78.07 Favored 'General case' 0 C--N 1.326 -0.427 0 C-N-CA 119.682 -0.807 . . . . 0.0 110.871 -179.356 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.11 -40.64 85.99 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 178.211 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.4 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.37 -50.98 65.56 Favored 'General case' 0 C--N 1.313 -0.99 0 CA-C-N 114.439 -1.255 . . . . 0.0 113.361 179.516 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.04 -42.13 89.53 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 -178.9 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.0 t -70.55 -49.66 50.83 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.935 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.177 -178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.1 t80 -55.12 -44.82 75.37 Favored 'General case' 0 C--N 1.321 -0.674 0 N-CA-C 109.963 -0.384 . . . . 0.0 109.963 -178.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.5 m -66.4 -36.94 84.11 Favored 'General case' 0 C--N 1.324 -0.539 0 C-N-CA 122.829 0.451 . . . . 0.0 110.997 179.782 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 5.7 mtt85 -58.32 -31.78 67.86 Favored 'General case' 0 C--N 1.325 -0.463 0 O-C-N 122.023 -0.423 . . . . 0.0 110.118 175.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.926 HD22 HG21 ' A' ' 508' ' ' VAL . 4.6 mt -76.64 -31.75 57.57 Favored 'General case' 0 CA--C 1.5 -0.958 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -176.392 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.89 -38.86 92.59 Favored 'General case' 0 C--O 1.214 -0.792 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.153 178.489 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.2 m -69.82 -17.9 63.42 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 113.267 0.84 . . . . 0.0 113.267 178.137 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 78.5 mtt85 -102.22 -0.66 32.7 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 178.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -99.78 -164.18 29.11 Favored Glycine 0 C--O 1.225 -0.424 0 N-CA-C 114.477 0.551 . . . . 0.0 114.477 -173.346 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 17.7 m . . . . . 0 C--O 1.243 0.728 0 C-N-CA 124.361 1.064 . . . . 0.0 112.174 -179.244 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.671 0 CA-C-O 118.643 -0.694 . . . . 0.0 109.629 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 57.47 -159.82 0.25 Allowed 'General case' 0 CA--C 1.542 0.666 0 O-C-N 124.188 0.93 . . . . 0.0 109.967 -177.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 23.3 t -151.73 142.1 14.91 Favored Pre-proline 0 C--N 1.324 -0.529 0 N-CA-C 105.581 -2.007 . . . . 0.0 105.581 178.227 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -69.01 150.08 72.4 Favored 'Trans proline' 0 C--O 1.24 0.625 0 C-N-CA 117.615 -1.123 . . . . 0.0 113.497 -179.725 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.9 m -69.4 167.8 15.79 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.645 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 41.1 t -55.87 -47.57 79.54 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.858 0 O-C-N 122.109 -0.37 . . . . 0.0 111.656 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.412 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.3 pt-20 -63.53 -33.95 76.71 Favored 'General case' 0 C--N 1.318 -0.793 0 N-CA-C 112.384 0.512 . . . . 0.0 112.384 -179.914 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.2 mt-10 -67.73 -42.32 82.1 Favored 'General case' 0 C--N 1.323 -0.559 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 177.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 12.4 mttt -69.66 -33.25 72.32 Favored 'General case' 0 CA--C 1.508 -0.657 0 CA-C-N 115.599 -0.728 . . . . 0.0 110.63 -178.384 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -56.16 -38.95 71.58 Favored 'General case' 0 C--N 1.32 -0.692 0 CA-C-N 114.949 -1.023 . . . . 0.0 109.741 -179.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -53.86 -39.53 65.73 Favored 'General case' 0 C--N 1.324 -0.503 0 C-N-CA 120.987 -0.285 . . . . 0.0 110.855 -178.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -70.9 -55.43 8.46 Favored 'General case' 0 C--O 1.219 -0.519 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 176.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.34 -47.72 78.23 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 114.156 1.169 . . . . 0.0 114.156 -176.484 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 18.1 t-160 -60.95 -40.31 92.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 109.042 -0.725 . . . . 0.0 109.042 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 64.6 m -64.85 -42.0 95.25 Favored 'General case' 0 C--N 1.328 -0.344 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.921 179.457 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 20.5 mm-40 -62.99 -41.79 99.66 Favored 'General case' 0 CA--C 1.5 -0.959 0 C-N-CA 120.824 -0.35 . . . . 0.0 111.03 178.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -54.41 -48.45 68.87 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.021 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 177.274 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 41.5 mtpt -65.9 -40.51 91.6 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 112.961 0.726 . . . . 0.0 112.961 -176.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -68.88 -26.59 65.2 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 120.655 0.264 . . . . 0.0 111.004 178.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -72.5 -17.68 61.73 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 178.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . 0.421 HD11 ' CG2' ' A' ' 526' ' ' ILE . 25.0 mt -103.93 12.14 34.66 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.789 0.292 . . . . 0.0 111.789 -179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -55.27 128.01 32.01 Favored 'General case' 0 C--O 1.21 -1.019 0 N-CA-C 107.153 -1.425 . . . . 0.0 107.153 178.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 52.5 t -63.0 -40.46 89.11 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.676 0 CA-C-O 122.117 0.96 . . . . 0.0 109.46 179.323 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -65.87 -31.64 72.69 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 113.981 -1.463 . . . . 0.0 112.691 -178.589 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 17.2 t -159.8 78.19 2.76 Favored Pre-proline 0 C--O 1.246 0.877 0 CA-C-N 116.259 -0.428 . . . . 0.0 111.799 -176.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.2 Cg_endo -73.29 148.73 44.18 Favored 'Trans proline' 0 C--N 1.345 0.372 0 C-N-CA 115.832 -2.312 . . . . 0.0 112.153 178.299 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -137.32 97.72 3.54 Favored 'General case' 0 C--N 1.323 -0.559 0 CA-C-O 121.61 0.719 . . . . 0.0 109.093 -178.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.436 HG22 ' HB3' ' A' ' 532' ' ' ASN . 70.8 t -59.13 -42.85 87.9 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.759 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.676 -178.427 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -60.46 -35.64 76.35 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 118.492 0.587 . . . . 0.0 110.871 -177.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 40.7 ttm180 -65.1 -43.07 93.25 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 121.097 0.475 . . . . 0.0 109.933 -179.69 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.467 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.3 OUTLIER -65.27 -50.39 65.94 Favored 'General case' 0 C--O 1.215 -0.72 0 N-CA-C 109.349 -0.612 . . . . 0.0 109.349 177.584 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 86.7 mt -56.9 -42.29 79.63 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 111.357 0.132 . . . . 0.0 111.357 -176.101 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -65.62 -38.57 89.81 Favored 'General case' 0 C--N 1.322 -0.591 0 CA-C-O 121.35 0.595 . . . . 0.0 111.67 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -66.57 -47.18 73.6 Favored 'General case' 0 C--N 1.323 -0.585 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 177.798 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.467 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -57.35 -42.71 82.55 Favored 'General case' 0 N--CA 1.433 -1.317 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.605 177.685 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -64.77 -37.15 86.64 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 119.073 0.851 . . . . 0.0 112.541 -177.474 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -69.83 -45.01 68.76 Favored 'General case' 0 C--O 1.225 -0.219 0 N-CA-C 107.515 -1.291 . . . . 0.0 107.515 177.775 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -56.76 -35.31 68.49 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-O 121.291 0.567 . . . . 0.0 110.927 -179.859 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.94 -19.27 67.53 Favored Glycine 0 C--O 1.24 0.506 0 N-CA-C 114.928 0.731 . . . . 0.0 114.928 -179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.3 t -109.06 -16.28 14.15 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 117.582 0.691 . . . . 0.0 110.091 -179.393 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.7 mt -65.03 144.16 57.47 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-O 121.348 0.594 . . . . 0.0 109.935 179.449 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.503 ' O ' HD13 ' A' ' 512' ' ' ILE . 47.4 mt-30 -78.12 84.52 4.35 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-O 122.01 0.91 . . . . 0.0 109.747 177.225 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.833 HG21 HD22 ' A' ' 546' ' ' LEU . 35.5 m -98.92 45.0 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.31 -1.114 0 CA-C-O 123.008 1.385 . . . . 0.0 108.03 179.723 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.45 173.69 3.16 Favored 'General case' 0 C--N 1.316 -0.89 0 CA-C-N 114.148 -1.387 . . . . 0.0 107.691 -177.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.28 -32.44 10.88 Favored 'General case' 0 N--CA 1.468 0.427 0 N-CA-C 113.812 1.041 . . . . 0.0 113.812 -173.556 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.49 -45.11 77.04 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 112.436 0.532 . . . . 0.0 112.436 176.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.503 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.66 -39.23 12.42 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.383 0 CA-C-O 121.2 0.524 . . . . 0.0 109.718 179.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.99 -35.82 75.85 Favored 'General case' 0 C--N 1.32 -0.714 0 N-CA-C 112.622 0.601 . . . . 0.0 112.622 -175.125 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 23.8 pt20 -64.74 -32.81 74.66 Favored 'General case' 0 C--N 1.325 -0.476 0 CA-C-O 121.567 0.698 . . . . 0.0 111.71 -179.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.0 ptmt -95.05 1.16 55.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 115.314 -0.857 . . . . 0.0 111.592 -179.58 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 38.0 m-80 -132.2 42.97 3.07 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 121.845 0.831 . . . . 0.0 111.917 178.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.0 p -65.22 -28.65 69.51 Favored 'General case' 0 C--N 1.321 -0.635 0 O-C-N 121.673 -0.642 . . . . 0.0 111.905 -179.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -67.38 -26.21 66.35 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-O 121.547 0.689 . . . . 0.0 111.991 177.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 65.5 t -70.24 -43.86 78.27 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 N-CA-C 106.647 -1.612 . . . . 0.0 106.647 178.381 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 44.0 t -62.49 -35.3 69.24 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.506 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 178.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.43 -39.88 94.78 Favored 'General case' 0 C--N 1.324 -0.51 0 CA-C-O 119.018 -0.515 . . . . 0.0 111.203 177.102 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 99.3 m -73.57 -39.15 64.87 Favored 'General case' 0 CA--C 1.511 -0.547 0 CA-C-N 119.33 0.968 . . . . 0.0 109.911 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.672 HD23 HD11 ' A' ' 526' ' ' ILE . 62.7 mt -57.87 -35.31 70.79 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-O 120.791 0.329 . . . . 0.0 111.09 178.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -65.35 -29.04 69.73 Favored 'General case' 0 N--CA 1.47 0.555 0 O-C-N 121.751 -0.593 . . . . 0.0 111.548 175.702 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 83.5 mttt -73.15 -44.63 59.76 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.021 0.438 . . . . 0.0 110.631 179.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.672 HD11 HD23 ' A' ' 523' ' ' LEU . 14.7 pt -78.26 -24.48 13.76 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.847 0 N-CA-C 115.301 1.593 . . . . 0.0 115.301 -175.654 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.499 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -59.26 -19.37 45.4 Favored 'General case' 0 C--O 1.213 -0.833 0 N-CA-C 112.23 0.455 . . . . 0.0 112.23 176.039 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -118.67 19.12 13.31 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 122.911 0.484 . . . . 0.0 111.784 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.401 ' HB2' ' HA ' ' A' ' 526' ' ' ILE . 7.9 t80 -73.19 104.62 4.31 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-O 121.232 0.539 . . . . 0.0 111.624 -176.389 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -68.32 -32.33 72.37 Favored 'General case' 0 N--CA 1.47 0.554 0 N-CA-C 116.419 2.007 . . . . 0.0 116.419 -175.455 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.68 -44.33 94.05 Favored 'General case' 0 N--CA 1.469 0.518 0 CA-C-O 122.195 0.998 . . . . 0.0 112.007 -176.551 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . 0.436 ' HB3' HG22 ' A' ' 493' ' ' VAL . 67.1 m-20 -113.99 90.34 3.32 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 106.653 -1.61 . . . . 0.0 106.653 -174.187 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -53.22 -50.0 65.63 Favored 'General case' 0 C--O 1.207 -1.163 0 O-C-N 122.33 -0.231 . . . . 0.0 110.958 -179.143 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -58.9 -37.74 77.3 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 120.845 0.355 . . . . 0.0 111.625 -176.549 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . 0.416 HG23 HG13 ' A' ' 493' ' ' VAL . 42.7 t -57.62 -44.41 85.3 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.559 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 176.322 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -63.93 -44.94 91.38 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 109.783 -0.451 . . . . 0.0 109.783 179.122 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.53 -47.67 80.69 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.579 0.585 . . . . 0.0 112.579 -179.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -70.44 -40.24 73.89 Favored 'General case' 0 CA--C 1.512 -0.511 0 C-N-CA 119.552 -0.859 . . . . 0.0 110.648 -177.919 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.89 -40.02 87.32 Favored 'General case' 0 C--O 1.207 -1.135 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 179.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.499 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -61.01 -49.41 77.51 Favored 'General case' 0 C--N 1.316 -0.882 0 N-CA-C 113.405 0.891 . . . . 0.0 113.405 178.062 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.34 -44.31 95.66 Favored 'General case' 0 C--N 1.319 -0.734 0 N-CA-C 108.832 -0.803 . . . . 0.0 108.832 179.44 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.4 t -67.54 -51.45 51.54 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.774 0 CA-C-N 116.252 -0.431 . . . . 0.0 111.059 -177.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 44.8 t80 -53.93 -46.2 71.46 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 122.787 0.435 . . . . 0.0 110.27 -177.691 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 33.2 m -63.29 -38.96 93.21 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 122.966 0.506 . . . . 0.0 110.982 179.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 95.8 mtt180 -62.21 -29.75 70.6 Favored 'General case' 0 C--O 1.215 -0.734 0 O-C-N 121.69 -0.631 . . . . 0.0 110.803 177.149 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.833 HD22 HG21 ' A' ' 508' ' ' VAL . 5.2 mt -75.12 -30.73 60.92 Favored 'General case' 0 CA--C 1.501 -0.914 0 N-CA-C 107.882 -1.155 . . . . 0.0 107.882 -178.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.21 -34.37 77.94 Favored 'General case' 0 C--O 1.211 -0.958 0 CA-C-N 115.421 -0.809 . . . . 0.0 109.712 177.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.0 m -81.45 -12.19 58.98 Favored 'General case' 0 C--N 1.32 -0.674 0 N-CA-C 113.279 0.844 . . . . 0.0 113.279 177.357 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.9 mtt-85 -97.55 -11.27 23.9 Favored 'General case' 0 N--CA 1.475 0.777 0 O-C-N 122.247 -0.283 . . . . 0.0 110.62 177.64 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -106.2 -177.64 23.48 Favored Glycine 0 C--O 1.225 -0.444 0 N-CA-C 111.04 -0.824 . . . . 0.0 111.04 -176.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 29.5 m . . . . . 0 C--O 1.246 0.894 0 O-C-N 124.967 1.039 . . . . 0.0 109.682 -177.029 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.72 -0.474 . . . . 0.0 109.72 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -72.77 155.66 39.72 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 107.712 -1.218 . . . . 0.0 107.712 177.308 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 45.9 m -79.97 128.97 72.06 Favored Pre-proline 0 C--N 1.322 -0.606 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -70.82 153.04 64.25 Favored 'Trans proline' 0 C--O 1.239 0.574 0 C-N-CA 117.914 -0.924 . . . . 0.0 113.224 179.116 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.9 m -67.96 164.01 20.88 Favored 'General case' 0 C--N 1.324 -0.527 0 CA-C-N 115.76 -0.654 . . . . 0.0 112.189 -179.457 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.445 HG13 ' HB3' ' A' ' 506' ' ' LEU . 38.0 t -54.17 -48.99 65.31 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.878 0 O-C-N 122.027 -0.421 . . . . 0.0 111.997 179.358 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.41 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.2 pt-20 -61.26 -34.2 74.78 Favored 'General case' 0 C--N 1.317 -0.833 0 N-CA-C 112.016 0.376 . . . . 0.0 112.016 -178.891 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -67.47 -41.77 84.07 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 108.291 -1.003 . . . . 0.0 108.291 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -72.51 -35.47 68.12 Favored 'General case' 0 CA--C 1.508 -0.654 0 CA-C-N 115.131 -0.941 . . . . 0.0 109.942 -177.665 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.553 HD21 HG21 ' A' ' 519' ' ' VAL . 3.8 tt -58.29 -37.83 75.82 Favored 'General case' 0 C--O 1.211 -0.971 0 CA-C-N 115.063 -0.971 . . . . 0.0 109.578 178.623 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -57.73 -41.87 82.71 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 118.593 0.633 . . . . 0.0 110.293 178.396 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -67.53 -53.17 30.79 Favored 'General case' 0 C--O 1.221 -0.429 0 C-N-CA 120.378 -0.529 . . . . 0.0 110.089 178.478 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -44.7 86.47 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 112.821 0.674 . . . . 0.0 112.821 -178.658 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.434 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.9 t-160 -58.31 -43.85 88.35 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 -179.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.9 m -63.77 -37.66 88.19 Favored 'General case' 0 C--N 1.328 -0.347 0 N-CA-C 112.002 0.371 . . . . 0.0 112.002 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 11.9 mm-40 -65.78 -37.66 86.91 Favored 'General case' 0 CA--C 1.504 -0.806 0 C-N-CA 120.514 -0.475 . . . . 0.0 110.193 178.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -58.08 -45.51 88.35 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.115 0 N-CA-C 106.712 -1.588 . . . . 0.0 106.712 178.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 24.4 mmtt -61.11 -45.63 93.9 Favored 'General case' 0 N--CA 1.48 1.045 0 N-CA-C 113.073 0.768 . . . . 0.0 113.073 179.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -64.17 -34.51 78.23 Favored 'General case' 0 N--CA 1.471 0.599 0 CA-C-O 120.715 0.293 . . . . 0.0 110.639 -178.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.73 -16.54 64.18 Favored 'General case' 0 C--N 1.323 -0.581 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 -179.488 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.9 mt -109.99 12.11 23.8 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 112.126 0.417 . . . . 0.0 112.126 -177.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 62.0 mttt -56.78 130.62 46.39 Favored 'General case' 0 C--O 1.21 -1.024 0 N-CA-C 107.231 -1.396 . . . . 0.0 107.231 177.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 46.2 t -62.5 -40.93 89.99 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.711 0 CA-C-O 122.303 1.049 . . . . 0.0 108.863 177.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 27.4 t70 -67.19 -30.19 70.07 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.638 -1.619 . . . . 0.0 113.093 -178.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.6 t -160.93 76.4 2.53 Favored Pre-proline 0 C--N 1.325 -0.481 0 N-CA-C 112.797 0.666 . . . . 0.0 112.797 -175.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -75.54 146.46 30.81 Favored 'Trans proline' 0 CA--C 1.534 0.476 0 C-N-CA 116.896 -1.603 . . . . 0.0 113.053 178.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.9 t0 -137.21 99.96 4.13 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 121.447 0.641 . . . . 0.0 110.354 178.56 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -56.3 -46.17 81.56 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.712 0 N-CA-C 113.295 0.85 . . . . 0.0 113.295 -178.781 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 5.2 pttt -58.43 -32.68 68.92 Favored 'General case' 0 CA--C 1.5 -0.943 0 CA-C-O 121.935 0.874 . . . . 0.0 109.773 -176.558 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.7 ttt180 -70.76 -39.87 73.01 Favored 'General case' 0 C--N 1.316 -0.88 0 CA-C-N 114.325 -1.307 . . . . 0.0 108.835 -175.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.409 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -66.01 -50.14 65.29 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 175.243 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 79.2 mt -56.62 -43.09 79.88 Favored 'General case' 0 N--CA 1.476 0.825 0 N-CA-C 112.381 0.511 . . . . 0.0 112.381 -175.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.74 -38.38 90.81 Favored 'General case' 0 C--N 1.323 -0.569 0 CA-C-O 121.619 0.723 . . . . 0.0 111.868 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -71.24 -45.24 63.69 Favored 'General case' 0 C--N 1.32 -0.691 0 O-C-N 121.655 -0.653 . . . . 0.0 109.617 178.45 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.409 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -55.04 -48.14 73.82 Favored 'General case' 0 N--CA 1.429 -1.517 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.804 177.243 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.3 pt-20 -62.33 -35.64 79.71 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.725 1.009 . . . . 0.0 113.725 -175.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 42.1 tp10 -67.41 -49.4 63.96 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 176.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -54.96 -33.51 62.42 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.282 -0.872 . . . . 0.0 110.393 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.95 -18.52 70.78 Favored Glycine 0 C--O 1.24 0.471 0 N-CA-C 115.176 0.831 . . . . 0.0 115.176 179.458 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.5 t -109.95 -13.36 14.43 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-N 118.085 0.942 . . . . 0.0 110.225 -179.432 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.445 ' HB3' HG13 ' A' ' 471' ' ' VAL . 5.2 mt -67.02 146.85 53.92 Favored 'General case' 0 C--N 1.326 -0.418 0 O-C-N 122.021 -0.424 . . . . 0.0 110.949 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.469 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.4 tt0 -78.65 84.43 4.75 Favored 'General case' 0 C--O 1.216 -0.675 0 CA-C-O 122.544 1.164 . . . . 0.0 109.103 177.213 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.913 HG21 HD22 ' A' ' 546' ' ' LEU . 27.0 m -98.82 47.39 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 CA-C-O 122.968 1.366 . . . . 0.0 108.708 -178.258 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.8 t -66.78 172.34 4.42 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 106.824 -1.546 . . . . 0.0 106.824 -178.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.0 m -49.17 -32.87 11.06 Favored 'General case' 0 C--O 1.212 -0.907 0 N-CA-C 113.433 0.901 . . . . 0.0 113.433 -173.705 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 52.1 tt0 -55.39 -44.81 76.49 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 112.129 0.418 . . . . 0.0 112.129 178.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.469 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -85.75 -41.83 15.63 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.448 0 CA-C-O 121.774 0.797 . . . . 0.0 109.231 179.029 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.484 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.69 -37.51 79.04 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -175.387 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -65.39 -31.98 73.38 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.604 0.716 . . . . 0.0 112.203 -178.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -93.72 -6.12 46.89 Favored 'General case' 0 C--N 1.32 -0.681 0 CA-C-N 115.223 -0.899 . . . . 0.0 112.085 -179.839 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.8 m120 -127.93 39.97 3.76 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-O 121.533 0.682 . . . . 0.0 111.819 -178.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 28.2 p -63.8 -24.83 67.91 Favored 'General case' 0 C--N 1.324 -0.505 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -178.68 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 12.8 m-20 -61.83 -32.54 72.87 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-O 121.475 0.655 . . . . 0.0 112.313 177.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.553 HG21 HD21 ' A' ' 475' ' ' LEU . 21.3 t -71.32 -40.99 74.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.629 0 N-CA-C 107.971 -1.122 . . . . 0.0 107.971 179.395 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 31.7 t -62.86 -38.36 81.64 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 178.655 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.42 -30.2 71.24 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.921 -0.581 . . . . 0.0 110.948 177.845 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.6 m -82.58 -39.26 22.51 Favored 'General case' 0 C--O 1.217 -0.63 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.48 HD23 HD11 ' A' ' 526' ' ' ILE . 31.9 mt -57.56 -36.53 71.79 Favored 'General case' 0 C--N 1.32 -0.699 0 CA-C-O 121.285 0.564 . . . . 0.0 110.881 178.737 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.2 mtmt -62.44 -28.55 69.88 Favored 'General case' 0 CA--C 1.54 0.56 0 O-C-N 122.165 -0.335 . . . . 0.0 111.536 175.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 55.2 mttm -76.96 -42.18 40.12 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 178.227 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.48 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -78.76 -22.23 12.95 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.106 0 N-CA-C 113.989 1.107 . . . . 0.0 113.989 -177.303 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.432 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -60.52 -18.12 50.02 Favored 'General case' 0 C--O 1.213 -0.836 0 C-N-CA 122.431 0.292 . . . . 0.0 111.547 175.674 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 23.9 ptt-85 -118.67 19.38 13.22 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 123.198 0.599 . . . . 0.0 111.571 178.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -66.64 110.35 3.18 Favored 'General case' 0 C--N 1.325 -0.481 0 CA-C-O 121.195 0.521 . . . . 0.0 112.187 -176.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.1 mttt -74.39 -28.05 60.92 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 115.834 1.79 . . . . 0.0 115.834 -176.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.15 -41.67 94.5 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 112.182 0.438 . . . . 0.0 112.182 -175.468 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.8 m120 -131.94 111.05 11.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 -178.244 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.3 tptt -55.58 -44.24 76.73 Favored 'General case' 0 C--O 1.207 -1.147 0 CA-C-N 116.366 -0.379 . . . . 0.0 111.045 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.2 t0 -55.9 -42.74 76.45 Favored 'General case' 0 C--N 1.323 -0.556 0 CA-C-O 121.004 0.431 . . . . 0.0 112.058 -177.106 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -57.56 -44.38 84.97 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 N-CA-C 109.581 -0.525 . . . . 0.0 109.581 177.24 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -62.83 -44.49 96.01 Favored 'General case' 0 C--N 1.324 -0.532 0 CA-C-O 119.218 -0.42 . . . . 0.0 110.063 179.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -65.25 -46.89 78.74 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.3 tptt -69.04 -39.66 79.07 Favored 'General case' 0 C--O 1.222 -0.386 0 C-N-CA 119.1 -1.04 . . . . 0.0 111.071 -179.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.72 -40.26 87.4 Favored 'General case' 0 C--O 1.212 -0.87 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 178.426 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.432 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.42 -50.44 71.49 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 114.796 -1.093 . . . . 0.0 113.287 178.657 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -45.5 89.72 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 179.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 60.6 t -67.11 -49.57 71.83 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.979 0 CA-C-N 116.422 -0.354 . . . . 0.0 111.202 -177.084 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 67.0 t80 -56.01 -44.98 79.21 Favored 'General case' 0 C--N 1.319 -0.753 0 N-CA-C 110.01 -0.367 . . . . 0.0 110.01 -177.89 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 26.6 m -66.12 -35.63 81.0 Favored 'General case' 0 C--N 1.323 -0.555 0 CA-C-O 121.295 0.569 . . . . 0.0 111.161 179.417 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 54.2 mtt-85 -61.27 -27.81 68.74 Favored 'General case' 0 C--N 1.323 -0.556 0 O-C-N 121.705 -0.622 . . . . 0.0 110.469 175.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.913 HD22 HG21 ' A' ' 508' ' ' VAL . 9.9 mt -76.48 -35.78 58.22 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 -176.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.36 -28.01 69.71 Favored 'General case' 0 C--O 1.215 -0.717 0 CA-C-N 114.735 -1.121 . . . . 0.0 111.432 178.32 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.6 m -79.16 -8.69 59.2 Favored 'General case' 0 C--N 1.314 -0.961 0 CA-C-N 114.683 -1.144 . . . . 0.0 111.662 178.137 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 73.0 mtt85 -117.64 -21.91 8.31 Favored 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -179.618 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -162.5 167.23 36.94 Favored Glycine 0 C--O 1.237 0.317 0 C-N-CA 121.342 -0.456 . . . . 0.0 112.187 -177.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 8.7 m . . . . . 0 C--O 1.248 0.993 0 N-CA-C 113.328 0.862 . . . . 0.0 113.328 -176.695 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.591 0 N-CA-C 109.596 -0.52 . . . . 0.0 109.596 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -72.84 162.36 29.58 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 176.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.9 p -143.33 150.23 50.94 Favored Pre-proline 0 C--N 1.323 -0.557 0 N-CA-C 107.366 -1.346 . . . . 0.0 107.366 178.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -68.85 152.3 73.8 Favored 'Trans proline' 0 C--O 1.236 0.423 0 N-CA-C 113.839 0.669 . . . . 0.0 113.839 -179.81 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.8 m -71.18 166.19 22.0 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.557 179.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 39.3 t -53.76 -48.41 61.25 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.05 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 -179.454 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -63.16 -34.21 77.13 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 112.091 0.404 . . . . 0.0 112.091 -178.34 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -66.69 -39.92 88.32 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 108.151 -1.055 . . . . 0.0 108.151 179.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -74.16 -35.79 64.05 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.133 -0.939 . . . . 0.0 110.214 -178.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.555 HD21 HG21 ' A' ' 519' ' ' VAL . 5.2 tt -58.63 -38.68 78.56 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 115.047 -0.978 . . . . 0.0 109.332 178.254 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 9.9 mm-40 -55.21 -40.32 70.66 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 109.686 -0.487 . . . . 0.0 109.686 178.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.7 tttp -71.8 -53.61 12.81 Favored 'General case' 0 C--O 1.219 -0.532 0 C-N-CA 120.452 -0.499 . . . . 0.0 110.27 177.675 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.15 -45.84 79.47 Favored 'General case' 0 C--O 1.218 -0.604 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 -178.32 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.45 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.9 t-160 -59.13 -41.94 89.44 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 108.458 -0.941 . . . . 0.0 108.458 -179.585 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.5 m -65.21 -40.02 93.59 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 119.441 -0.314 . . . . 0.0 111.196 179.413 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.5 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 50.5 mm-40 -65.02 -40.51 94.98 Favored 'General case' 0 CA--C 1.512 -0.498 0 C-N-CA 120.082 -0.647 . . . . 0.0 110.368 178.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.9 mt -54.29 -48.5 67.35 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.06 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 176.994 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.9 mtpt -65.89 -38.36 88.55 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 113.126 0.787 . . . . 0.0 113.126 -177.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -66.84 -32.35 73.56 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 120.664 0.269 . . . . 0.0 110.299 177.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.59 -20.42 66.0 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 112.318 0.488 . . . . 0.0 112.318 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.9 mt -101.15 12.05 38.32 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 -178.788 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 12.6 mtpp -56.72 122.22 11.62 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 177.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 40.1 t -60.98 -39.04 80.85 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.628 0 CA-C-O 122.481 1.134 . . . . 0.0 109.4 178.727 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -64.26 -28.21 69.57 Favored 'General case' 0 C--N 1.317 -0.81 0 CA-C-N 113.525 -1.67 . . . . 0.0 112.811 -178.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -168.73 81.13 0.74 Allowed Pre-proline 0 N--CA 1.47 0.538 0 CA-C-N 116.459 -0.337 . . . . 0.0 111.13 -179.281 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 86.5 Cg_endo -75.87 149.44 33.28 Favored 'Trans proline' 0 C--N 1.345 0.367 0 C-N-CA 118.083 -0.811 . . . . 0.0 113.182 179.93 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.6 t0 -137.28 99.23 3.92 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.526 0.679 . . . . 0.0 110.871 -179.684 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.96 -45.36 87.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 112.98 0.733 . . . . 0.0 112.98 -179.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -58.79 -32.13 69.05 Favored 'General case' 0 CA--C 1.506 -0.725 0 N-CA-C 109.553 -0.536 . . . . 0.0 109.553 -178.047 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.2 ttt180 -69.49 -40.28 77.12 Favored 'General case' 0 C--N 1.321 -0.665 0 N-CA-C 108.891 -0.781 . . . . 0.0 108.891 -176.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.431 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.99 -49.92 66.1 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 109.006 -0.739 . . . . 0.0 109.006 176.053 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 83.9 mt -56.64 -43.97 80.83 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -176.002 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.4 t30 -63.5 -37.45 87.36 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-O 121.565 0.698 . . . . 0.0 111.447 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.5 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -70.48 -47.49 60.29 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-O 121.365 0.603 . . . . 0.0 109.601 178.076 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.431 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.65 -49.01 71.61 Favored 'General case' 0 N--CA 1.429 -1.524 0 CA-C-N 115.465 -0.789 . . . . 0.0 111.227 178.021 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.2 pt-20 -61.73 -35.37 77.87 Favored 'General case' 0 C--N 1.323 -0.584 0 N-CA-C 113.225 0.824 . . . . 0.0 113.225 -175.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.64 -47.86 57.89 Favored 'General case' 0 C--O 1.224 -0.266 0 N-CA-C 108.039 -1.097 . . . . 0.0 108.039 176.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -56.7 -34.02 67.04 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.401 0.62 . . . . 0.0 110.197 -178.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.94 -17.89 68.09 Favored Glycine 0 C--O 1.236 0.259 0 N-CA-C 115.292 0.877 . . . . 0.0 115.292 179.722 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.9 t -110.86 -11.31 14.37 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 118.003 0.901 . . . . 0.0 110.235 -179.424 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 4.7 mt -68.85 148.87 49.62 Favored 'General case' 0 C--O 1.237 0.42 0 O-C-N 121.939 -0.475 . . . . 0.0 110.296 -179.804 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.445 ' O ' HD13 ' A' ' 512' ' ' ILE . 26.5 tt0 -77.28 84.48 3.72 Favored 'General case' 0 C--O 1.217 -0.636 0 CA-C-O 122.719 1.247 . . . . 0.0 109.087 177.507 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.901 HG21 HD22 ' A' ' 546' ' ' LEU . 31.1 m -100.28 50.18 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 CA-C-O 122.969 1.366 . . . . 0.0 108.167 -178.188 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.1 t -66.53 171.87 4.64 Favored 'General case' 0 C--N 1.311 -1.079 0 N-CA-C 106.879 -1.526 . . . . 0.0 106.879 179.398 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 40.4 m -49.32 -31.49 9.27 Favored 'General case' 0 C--O 1.214 -0.802 0 N-CA-C 113.186 0.81 . . . . 0.0 113.186 -175.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -55.43 -45.08 76.8 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 111.801 0.297 . . . . 0.0 111.801 178.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.445 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.1 mp -86.05 -42.88 16.19 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.542 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 179.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.17 -37.98 81.82 Favored 'General case' 0 C--N 1.319 -0.729 0 N-CA-C 113.542 0.942 . . . . 0.0 113.542 -175.307 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -69.23 -30.29 68.41 Favored 'General case' 0 C--N 1.324 -0.512 0 C-N-CA 120.913 -0.315 . . . . 0.0 111.219 -178.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -89.16 -5.24 57.88 Favored 'General case' 0 N--CA 1.471 0.576 0 O-C-N 122.187 -0.321 . . . . 0.0 110.901 177.986 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 53.0 m-80 -129.87 43.95 3.05 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-O 121.591 0.71 . . . . 0.0 112.426 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.8 p -63.66 -25.27 68.14 Favored 'General case' 0 C--N 1.323 -0.577 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -179.025 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.08 -31.61 72.91 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-O 122.001 0.905 . . . . 0.0 111.922 178.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.555 HG21 HD21 ' A' ' 475' ' ' LEU . 57.8 t -69.53 -42.84 80.86 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.755 0 N-CA-C 107.42 -1.326 . . . . 0.0 107.42 179.073 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 26.5 t -62.72 -38.07 80.7 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.576 0 N-CA-C 108.225 -1.028 . . . . 0.0 108.225 178.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.93 -39.05 93.41 Favored 'General case' 0 N--CA 1.449 -0.506 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.334 177.4 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 92.6 m -73.68 -38.08 65.03 Favored 'General case' 0 CA--C 1.51 -0.579 0 CA-C-N 118.483 0.583 . . . . 0.0 110.464 -178.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.66 HD23 HD11 ' A' ' 526' ' ' ILE . 63.1 mt -58.7 -35.75 73.13 Favored 'General case' 0 C--N 1.321 -0.669 0 CA-C-O 121.136 0.493 . . . . 0.0 110.593 178.222 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.1 mtmt -65.77 -29.14 69.6 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 121.878 -0.514 . . . . 0.0 111.357 175.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 69.0 mttt -72.22 -45.51 59.97 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-O 120.915 0.388 . . . . 0.0 110.808 178.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.66 HD11 HD23 ' A' ' 523' ' ' LEU . 16.6 pt -78.75 -20.61 12.99 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.806 0 N-CA-C 115.008 1.484 . . . . 0.0 115.008 -176.592 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.428 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.4 OUTLIER -62.45 -17.56 59.69 Favored 'General case' 0 C--O 1.213 -0.864 0 O-C-N 121.783 -0.573 . . . . 0.0 111.897 176.022 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.7 19.35 13.21 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.217 0.607 . . . . 0.0 111.411 177.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.7 t80 -65.5 114.65 5.03 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 121.024 0.44 . . . . 0.0 111.943 -177.334 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.8 mttt -75.2 -29.92 60.48 Favored 'General case' 0 C--O 1.217 -0.611 0 N-CA-C 115.682 1.734 . . . . 0.0 115.682 -176.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.45 -40.72 96.26 Favored 'General case' 0 C--N 1.327 -0.413 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -174.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.2 m120 -132.57 112.1 11.79 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-N 116.572 -0.286 . . . . 0.0 110.23 -178.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 40.2 tptt -56.67 -43.69 80.64 Favored 'General case' 0 C--O 1.208 -1.127 0 CA-C-N 116.453 -0.34 . . . . 0.0 110.388 178.325 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.3 t0 -55.74 -43.27 76.46 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 112.189 0.441 . . . . 0.0 112.189 -177.309 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 67.4 t -57.35 -44.51 84.35 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.545 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -63.85 -43.53 95.85 Favored 'General case' 0 CA--C 1.511 -0.545 0 N-CA-C 110.082 -0.34 . . . . 0.0 110.082 179.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.99 -47.94 75.74 Favored 'General case' 0 C--N 1.324 -0.505 0 C-N-CA 120.532 -0.467 . . . . 0.0 111.858 -179.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.2 tptt -69.28 -38.98 78.6 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 118.864 -1.134 . . . . 0.0 110.586 -178.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . 0.402 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -59.37 -41.26 88.88 Favored 'General case' 0 C--O 1.213 -0.856 0 CA-C-O 121.442 0.639 . . . . 0.0 109.498 178.827 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.428 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.91 -48.25 77.34 Favored 'General case' 0 C--N 1.314 -0.967 0 CA-C-N 114.913 -1.04 . . . . 0.0 112.924 179.474 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.08 -41.51 92.58 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 109.165 -0.679 . . . . 0.0 109.165 179.636 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 52.8 t -70.6 -51.25 38.73 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.789 0 CA-C-N 116.071 -0.513 . . . . 0.0 111.286 -178.216 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.2 t80 -54.63 -45.9 73.83 Favored 'General case' 0 C--N 1.322 -0.628 0 C-N-CA 122.499 0.32 . . . . 0.0 110.278 -177.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 16.0 m -65.78 -34.61 78.56 Favored 'General case' 0 C--N 1.323 -0.565 0 CA-C-O 121.289 0.566 . . . . 0.0 111.197 179.872 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -63.01 -28.76 70.32 Favored 'General case' 0 C--N 1.323 -0.546 0 O-C-N 121.803 -0.561 . . . . 0.0 109.966 175.396 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.901 HD22 HG21 ' A' ' 508' ' ' VAL . 9.1 mt -76.57 -33.33 58.49 Favored 'General case' 0 C--O 1.207 -1.143 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 -176.53 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.54 -27.28 69.15 Favored 'General case' 0 C--O 1.216 -0.68 0 CA-C-N 115.161 -0.927 . . . . 0.0 111.208 178.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.5 m -79.13 -8.51 59.04 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 114.544 -1.207 . . . . 0.0 111.866 177.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 69.0 mtt85 -117.99 -26.05 6.54 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -179.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -162.11 165.71 36.04 Favored Glycine 0 C--O 1.237 0.297 0 N-CA-C 112.302 -0.319 . . . . 0.0 112.302 -177.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 9.2 m . . . . . 0 C--O 1.241 0.655 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -176.837 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.777 0 CA-C-O 118.523 -0.751 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 53.4 35.05 19.47 Favored 'General case' 0 N--CA 1.475 0.811 0 O-C-N 124.022 0.826 . . . . 0.0 110.209 -177.193 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 56.0 p -135.67 67.43 65.29 Favored Pre-proline 0 C--N 1.325 -0.471 0 CA-C-N 115.297 -0.865 . . . . 0.0 111.438 -174.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.4 149.76 63.32 Favored 'Trans proline' 0 C--O 1.243 0.762 0 C-N-CA 117.223 -1.385 . . . . 0.0 113.777 -178.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.7 m -71.45 168.17 18.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.184 179.461 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 51.7 t -55.86 -46.77 80.21 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.92 0 CA-C-O 120.879 0.371 . . . . 0.0 111.626 179.22 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.9 OUTLIER -65.92 -34.1 77.36 Favored 'General case' 0 C--N 1.317 -0.822 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -178.894 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -67.92 -40.86 83.33 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 108.335 -0.987 . . . . 0.0 108.335 176.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -69.14 -34.66 75.37 Favored 'General case' 0 CA--C 1.508 -0.66 0 CA-C-N 115.779 -0.646 . . . . 0.0 110.035 -178.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -56.09 -39.9 72.83 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-N 115.148 -0.933 . . . . 0.0 109.398 -179.367 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 87.7 mt-30 -53.4 -39.7 64.51 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 120.886 -0.326 . . . . 0.0 110.995 -178.721 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 74.9 tttt -70.69 -56.49 6.29 Favored 'General case' 0 C--N 1.328 -0.361 0 C-N-CA 120.97 -0.292 . . . . 0.0 110.619 176.755 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.94 -45.8 86.04 Favored 'General case' 0 CA--C 1.507 -0.707 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -176.118 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -59.49 -42.65 92.61 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 -179.708 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 58.5 m -63.59 -38.45 91.17 Favored 'General case' 0 C--N 1.329 -0.319 0 O-C-N 123.075 0.234 . . . . 0.0 111.306 -179.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.407 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 10.8 mm-40 -64.25 -38.25 90.39 Favored 'General case' 0 CA--C 1.507 -0.697 0 C-N-CA 120.543 -0.463 . . . . 0.0 110.649 178.209 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 92.5 mt -59.93 -41.73 87.0 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.088 0 N-CA-C 106.772 -1.566 . . . . 0.0 106.772 179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 51.6 mmtt -64.5 -45.22 88.2 Favored 'General case' 0 N--CA 1.479 1.008 0 O-C-N 121.832 -0.543 . . . . 0.0 112.068 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.4 m-85 -65.77 -32.17 73.55 Favored 'General case' 0 C--N 1.324 -0.516 0 CA-C-O 120.712 0.292 . . . . 0.0 110.794 -178.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.63 -16.97 64.58 Favored 'General case' 0 C--N 1.321 -0.656 0 N-CA-C 112.434 0.531 . . . . 0.0 112.434 178.627 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 34.5 mt -111.21 12.3 21.8 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 111.976 0.362 . . . . 0.0 111.976 -177.214 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 43.8 mttt -54.19 133.33 44.38 Favored 'General case' 0 C--O 1.213 -0.866 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 177.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 63.5 t -63.81 -42.32 95.5 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.825 0 CA-C-O 122.264 1.031 . . . . 0.0 108.393 176.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.0 t70 -68.29 -28.32 67.08 Favored 'General case' 0 C--N 1.32 -0.69 0 CA-C-N 113.735 -1.575 . . . . 0.0 113.597 -178.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 20.3 m -157.59 73.53 4.25 Favored Pre-proline 0 N--CA 1.472 0.645 0 N-CA-C 113.243 0.831 . . . . 0.0 113.243 -176.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -72.25 143.37 39.38 Favored 'Trans proline' 0 CA--C 1.532 0.422 0 C-N-CA 115.194 -2.737 . . . . 0.0 112.204 178.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.3 t0 -137.28 100.65 4.31 Favored 'General case' 0 C--N 1.325 -0.484 0 CA-C-O 121.689 0.756 . . . . 0.0 110.563 -178.714 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -59.6 -47.28 91.58 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.867 0 N-CA-C 112.71 0.633 . . . . 0.0 112.71 -178.943 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 94.1 mttt -57.59 -31.85 66.59 Favored 'General case' 0 CA--C 1.506 -0.716 0 O-C-N 123.301 0.376 . . . . 0.0 110.04 -177.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 55.1 ttt180 -70.88 -39.4 72.87 Favored 'General case' 0 C--N 1.32 -0.697 0 N-CA-C 109.238 -0.653 . . . . 0.0 109.238 -177.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -66.1 -48.96 69.2 Favored 'General case' 0 C--O 1.216 -0.697 0 N-CA-C 108.559 -0.904 . . . . 0.0 108.559 176.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 59.9 mt -56.86 -42.38 79.65 Favored 'General case' 0 N--CA 1.473 0.677 0 CA-C-O 120.489 0.185 . . . . 0.0 111.314 -175.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 9.9 t-20 -67.01 -36.8 82.95 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.44 0.638 . . . . 0.0 112.125 -179.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.407 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.78 -45.86 67.05 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.411 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.45 -44.1 80.14 Favored 'General case' 0 N--CA 1.432 -1.344 0 CA-C-N 114.746 -1.116 . . . . 0.0 111.086 178.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -63.41 -37.39 87.1 Favored 'General case' 0 C--N 1.324 -0.504 0 CA-C-N 119.156 0.889 . . . . 0.0 112.616 -177.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -70.51 -44.84 66.76 Favored 'General case' 0 C--N 1.331 -0.201 0 N-CA-C 107.679 -1.23 . . . . 0.0 107.679 177.608 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -56.31 -35.79 67.94 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 121.237 0.541 . . . . 0.0 111.323 -179.804 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.62 -20.35 69.95 Favored Glycine 0 C--O 1.24 0.506 0 N-CA-C 114.779 0.671 . . . . 0.0 114.779 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.2 t -107.14 -16.01 14.53 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 117.338 0.569 . . . . 0.0 110.081 -178.754 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -65.47 145.53 56.01 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 109.844 -0.428 . . . . 0.0 109.844 179.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.474 ' O ' HD13 ' A' ' 512' ' ' ILE . 28.2 tt0 -80.09 79.59 6.62 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-O 122.542 1.163 . . . . 0.0 109.167 178.21 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.827 HG21 HD22 ' A' ' 546' ' ' LEU . 29.6 m -94.07 47.18 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.169 0 CA-C-O 122.991 1.377 . . . . 0.0 107.628 179.426 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.21 173.69 3.02 Favored 'General case' 0 C--N 1.316 -0.879 0 N-CA-C 106.92 -1.511 . . . . 0.0 106.92 -178.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 13.8 m -48.32 -34.98 11.44 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.769 1.025 . . . . 0.0 113.769 -173.425 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.7 tt0 -54.86 -44.19 73.79 Favored 'General case' 0 CA--C 1.537 0.459 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 177.728 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.474 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -87.68 -38.74 12.26 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.439 0 N-CA-C 108.965 -0.754 . . . . 0.0 108.965 179.49 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.418 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.84 -36.75 79.91 Favored 'General case' 0 C--N 1.319 -0.724 0 N-CA-C 112.965 0.728 . . . . 0.0 112.965 -175.885 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -65.88 -32.29 73.72 Favored 'General case' 0 C--N 1.325 -0.471 0 CA-C-O 121.385 0.612 . . . . 0.0 111.983 -179.183 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -93.24 -1.64 55.94 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.493 179.349 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -129.46 44.94 2.88 Favored 'General case' 0 C--N 1.327 -0.394 0 CA-C-O 121.815 0.817 . . . . 0.0 112.099 178.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 23.7 p -65.51 -28.18 69.01 Favored 'General case' 0 C--N 1.32 -0.678 0 O-C-N 121.746 -0.596 . . . . 0.0 112.132 -179.401 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 14.8 m-20 -66.74 -27.21 67.43 Favored 'General case' 0 N--CA 1.473 0.698 0 CA-C-O 121.663 0.744 . . . . 0.0 111.838 177.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.7 t -70.72 -43.6 77.19 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.701 0 N-CA-C 106.78 -1.563 . . . . 0.0 106.78 178.628 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.8 t -63.53 -37.17 78.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 108.177 -1.046 . . . . 0.0 108.177 178.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.32 -33.71 76.11 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.297 -0.41 . . . . 0.0 110.918 177.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 80.1 m -78.69 -40.27 34.34 Favored 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.547 HD23 HD11 ' A' ' 526' ' ' ILE . 40.2 mt -57.61 -35.4 70.4 Favored 'General case' 0 C--N 1.32 -0.686 0 CA-C-O 121.124 0.488 . . . . 0.0 110.933 178.17 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.04 -26.92 68.78 Favored 'General case' 0 CA--C 1.541 0.597 0 O-C-N 121.895 -0.503 . . . . 0.0 111.886 175.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -76.47 -43.38 40.1 Favored 'General case' 0 N--CA 1.475 0.796 0 N-CA-C 111.794 0.294 . . . . 0.0 111.794 178.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.547 HD11 HD23 ' A' ' 523' ' ' LEU . 1.2 pt -78.81 -22.08 12.9 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.988 0 N-CA-C 113.759 1.022 . . . . 0.0 113.759 -177.33 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.468 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -64.49 -12.1 40.63 Favored 'General case' 0 C--O 1.215 -0.73 0 N-CA-C 112.358 0.503 . . . . 0.0 112.358 175.317 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.3 ptp180 -121.14 19.32 11.56 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 122.821 0.448 . . . . 0.0 110.474 175.592 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 12.2 t80 -63.7 112.78 3.0 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.494 0.664 . . . . 0.0 112.497 -174.419 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -78.37 -31.42 48.48 Favored 'General case' 0 N--CA 1.445 -0.7 0 N-CA-C 113.372 0.879 . . . . 0.0 113.372 -176.884 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.55 -26.96 65.68 Favored 'General case' 0 CA--C 1.536 0.432 0 N-CA-C 113.066 0.765 . . . . 0.0 113.066 -175.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -146.6 122.35 10.56 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.164 0.507 . . . . 0.0 112.354 176.933 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 47.1 tptt -64.15 -40.4 96.07 Favored 'General case' 0 C--O 1.213 -0.843 0 N-CA-C 113.533 0.938 . . . . 0.0 113.533 -177.591 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -61.85 -40.86 96.82 Favored 'General case' 0 C--N 1.322 -0.624 0 CA-C-O 121.552 0.692 . . . . 0.0 109.986 -176.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.3 t -58.03 -43.21 84.57 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.447 0 CA-C-N 116.329 -0.396 . . . . 0.0 110.089 176.996 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 32.5 ttm -59.73 -48.64 80.85 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-O 120.8 0.333 . . . . 0.0 110.852 -179.921 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 47.5 mm-40 -68.14 -45.72 72.82 Favored 'General case' 0 C--N 1.314 -0.961 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -178.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 44.7 tptt -69.51 -38.5 77.61 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 118.931 -1.107 . . . . 0.0 110.482 -177.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -60.13 -38.93 84.54 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 177.922 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.468 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.62 -48.91 70.65 Favored 'General case' 0 C--N 1.314 -0.971 0 CA-C-N 114.716 -1.129 . . . . 0.0 113.981 179.37 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.62 -40.5 87.79 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.849 -0.797 . . . . 0.0 108.849 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 61.9 t -70.59 -53.02 24.16 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.867 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.563 -179.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.6 t80 -53.8 -45.1 70.63 Favored 'General case' 0 C--N 1.322 -0.624 0 C-N-CA 122.372 0.269 . . . . 0.0 111.22 -176.509 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 25.3 m -65.05 -36.98 86.08 Favored 'General case' 0 C--N 1.322 -0.612 0 C-N-CA 123.171 0.588 . . . . 0.0 111.157 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 37.2 mtt85 -62.08 -29.96 70.67 Favored 'General case' 0 C--O 1.216 -0.674 0 O-C-N 121.563 -0.711 . . . . 0.0 110.59 176.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.827 HD22 HG21 ' A' ' 508' ' ' VAL . 4.7 mt -76.38 -31.12 57.82 Favored 'General case' 0 CA--C 1.5 -0.968 0 N-CA-C 107.55 -1.278 . . . . 0.0 107.55 -175.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.94 -42.49 99.17 Favored 'General case' 0 C--O 1.215 -0.748 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 175.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 18.0 m -68.63 -24.16 64.52 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 112.832 0.679 . . . . 0.0 112.832 178.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -89.64 -4.72 57.65 Favored 'General case' 0 N--CA 1.474 0.756 0 O-C-N 122.194 -0.316 . . . . 0.0 111.011 177.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -134.59 48.95 0.92 Allowed Glycine 0 CA--C 1.51 -0.221 0 N-CA-C 112.029 -0.428 . . . . 0.0 112.029 -175.092 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 66.9 m . . . . . 0 C--O 1.253 1.27 0 N-CA-C 103.162 -2.903 . . . . 0.0 103.162 177.893 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.666 0 N-CA-C 109.691 -0.485 . . . . 0.0 109.691 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -73.58 160.64 31.34 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 107.219 -1.401 . . . . 0.0 107.219 176.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 28.6 m -75.31 141.95 74.42 Favored Pre-proline 0 C--N 1.323 -0.582 0 N-CA-C 107.87 -1.159 . . . . 0.0 107.87 176.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 67.4 Cg_endo -68.42 150.88 76.06 Favored 'Trans proline' 0 C--O 1.238 0.524 0 C-N-CA 117.928 -0.914 . . . . 0.0 113.5 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.6 m -70.04 164.57 23.72 Favored 'General case' 0 C--N 1.325 -0.473 0 CA-C-N 115.566 -0.743 . . . . 0.0 111.798 -179.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 41.1 t -53.63 -46.09 60.67 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.947 0 O-C-N 122.016 -0.427 . . . . 0.0 112.103 179.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -65.03 -34.14 77.73 Favored 'General case' 0 C--N 1.316 -0.865 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -178.85 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -67.54 -40.2 85.03 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 107.765 -1.198 . . . . 0.0 107.765 178.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 61.2 mtpt -73.07 -32.72 65.21 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.056 -0.975 . . . . 0.0 110.228 -177.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.419 HD23 HD21 ' A' ' 503' ' ' LEU . 1.9 tm? -57.43 -39.34 76.02 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-N 115.04 -0.982 . . . . 0.0 109.062 178.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -53.2 -39.83 63.99 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 117.87 0.304 . . . . 0.0 110.268 -179.024 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.4 tttp -71.72 -57.28 4.51 Favored 'General case' 0 C--O 1.22 -0.466 0 C-N-CA 120.396 -0.522 . . . . 0.0 110.866 177.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.79 -45.88 78.12 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 114.143 1.164 . . . . 0.0 114.143 -176.858 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 19.5 t-160 -59.31 -42.01 90.4 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 108.831 -0.803 . . . . 0.0 108.831 -179.702 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 54.9 m -65.14 -37.78 88.51 Favored 'General case' 0 C--N 1.328 -0.341 0 O-C-N 123.13 0.268 . . . . 0.0 111.476 -179.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.49 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 46.5 mm-40 -64.74 -37.05 86.3 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 119.961 -0.695 . . . . 0.0 110.279 178.745 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -59.1 -42.58 86.99 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.063 0 N-CA-C 107.071 -1.455 . . . . 0.0 107.071 178.817 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 51.9 mmtt -62.51 -46.87 86.46 Favored 'General case' 0 N--CA 1.478 0.945 0 N-CA-C 111.972 0.36 . . . . 0.0 111.972 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 28.1 m-85 -65.35 -33.13 75.25 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 120.89 0.376 . . . . 0.0 111.224 -178.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.01 -17.32 64.61 Favored 'General case' 0 C--N 1.32 -0.699 0 N-CA-C 112.849 0.685 . . . . 0.0 112.849 179.475 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 32.6 mt -110.48 12.0 22.99 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.08 0.4 . . . . 0.0 112.08 -176.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 20.5 mtpt -55.3 130.06 40.89 Favored 'General case' 0 C--O 1.208 -1.094 0 N-CA-C 107.18 -1.415 . . . . 0.0 107.18 177.557 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 51.0 t -63.01 -40.49 89.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.753 0 CA-C-O 122.267 1.032 . . . . 0.0 108.88 178.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -67.17 -29.87 69.68 Favored 'General case' 0 C--N 1.319 -0.725 0 CA-C-N 113.756 -1.565 . . . . 0.0 113.011 -178.763 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 18.1 t -161.45 78.97 2.16 Favored Pre-proline 0 C--N 1.325 -0.467 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 98.8 Cg_endo -74.56 146.17 34.27 Favored 'Trans proline' 0 CA--C 1.533 0.444 0 C-N-CA 118.11 -0.794 . . . . 0.0 112.767 178.571 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.7 t0 -137.28 101.17 4.45 Favored 'General case' 0 C--N 1.326 -0.455 0 CA-C-O 121.679 0.752 . . . . 0.0 110.804 -179.534 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.407 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.7 OUTLIER -60.05 -45.26 95.79 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 113.59 0.959 . . . . 0.0 113.59 -179.149 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.0 mttt -61.76 -31.08 71.25 Favored 'General case' 0 CA--C 1.505 -0.785 0 N-CA-C 109.252 -0.648 . . . . 0.0 109.252 -177.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.5 ttt180 -69.19 -41.3 77.33 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 -178.075 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.433 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -65.0 -48.29 74.48 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 108.739 -0.837 . . . . 0.0 108.739 176.004 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 73.7 mt -56.69 -44.96 82.01 Favored 'General case' 0 N--CA 1.468 0.464 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.18 -41.0 97.93 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.799 0.809 . . . . 0.0 110.053 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.49 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.11 -48.16 68.97 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.339 0.59 . . . . 0.0 109.847 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.433 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.5 -45.76 84.54 Favored 'General case' 0 N--CA 1.432 -1.329 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.379 178.944 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -63.25 -35.37 80.12 Favored 'General case' 0 C--N 1.32 -0.682 0 CA-C-N 119.006 0.821 . . . . 0.0 112.475 -176.366 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -71.82 -43.8 64.98 Favored 'General case' 0 C--N 1.331 -0.218 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 177.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.419 HD21 HD23 ' A' ' 475' ' ' LEU . 0.2 OUTLIER -56.18 -33.86 65.67 Favored 'General case' 0 CA--C 1.537 0.448 0 CA-C-O 121.511 0.672 . . . . 0.0 110.657 177.736 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.1 -16.42 66.6 Favored Glycine 0 C--O 1.239 0.411 0 CA-C-O 119.204 -0.775 . . . . 0.0 114.526 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.8 t -113.9 -14.3 12.49 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 118.042 0.921 . . . . 0.0 110.889 -179.598 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.5 mt -66.48 145.97 55.06 Favored 'General case' 0 C--O 1.236 0.394 0 O-C-N 121.877 -0.514 . . . . 0.0 109.829 178.685 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.416 ' O ' HD13 ' A' ' 512' ' ' ILE . 30.0 tt0 -79.11 84.42 5.09 Favored 'General case' 0 C--O 1.218 -0.601 0 CA-C-O 122.836 1.303 . . . . 0.0 109.566 178.005 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.975 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -96.59 48.76 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-O 123.18 1.467 . . . . 0.0 107.996 -178.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.5 t -66.84 172.23 4.57 Favored 'General case' 0 C--N 1.317 -0.84 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 -178.17 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 2.7 m -49.26 -34.88 16.19 Favored 'General case' 0 C--O 1.217 -0.636 0 N-CA-C 113.595 0.961 . . . . 0.0 113.595 -173.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.2 tt0 -54.72 -44.63 73.67 Favored 'General case' 0 C--N 1.324 -0.535 0 N-CA-C 111.82 0.304 . . . . 0.0 111.82 177.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -86.12 -41.66 15.33 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.373 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 -179.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.43 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.63 -38.86 82.51 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 113.573 0.953 . . . . 0.0 113.573 -175.32 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -69.33 -31.94 70.72 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-N 116.35 -0.387 . . . . 0.0 110.824 -177.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.6 ptmt -88.42 -3.96 58.73 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 121.091 -0.244 . . . . 0.0 111.232 177.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -127.52 45.34 2.75 Favored 'General case' 0 C--N 1.327 -0.398 0 CA-C-O 121.858 0.837 . . . . 0.0 112.465 179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 17.5 p -64.91 -28.71 69.72 Favored 'General case' 0 C--N 1.32 -0.7 0 O-C-N 121.699 -0.626 . . . . 0.0 112.568 -179.618 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -69.7 -22.5 63.41 Favored 'General case' 0 N--CA 1.474 0.759 0 CA-C-O 121.503 0.668 . . . . 0.0 112.09 178.441 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 87.9 t -71.55 -45.17 69.08 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.696 0 N-CA-C 105.951 -1.87 . . . . 0.0 105.951 177.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 50.6 t -62.94 -36.79 77.2 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.54 0 N-CA-C 107.974 -1.121 . . . . 0.0 107.974 178.553 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.13 -35.57 79.14 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 116.589 -0.278 . . . . 0.0 111.407 177.738 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.1 m -77.63 -39.08 46.42 Favored 'General case' 0 C--O 1.219 -0.503 0 CA-C-N 118.47 0.577 . . . . 0.0 109.698 179.651 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.687 HD23 HD11 ' A' ' 526' ' ' ILE . 48.8 mt -59.11 -31.89 69.34 Favored 'General case' 0 C--N 1.321 -0.648 0 CA-C-O 121.064 0.459 . . . . 0.0 111.464 179.094 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -64.73 -29.11 70.08 Favored 'General case' 0 N--CA 1.468 0.471 0 O-C-N 121.757 -0.589 . . . . 0.0 111.199 175.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 84.9 mttt -74.58 -42.59 58.46 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.174 0.435 . . . . 0.0 112.174 -179.239 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.687 HD11 HD23 ' A' ' 523' ' ' LEU . 1.3 pt -78.8 -22.42 12.92 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.905 0 N-CA-C 114.919 1.452 . . . . 0.0 114.919 -176.518 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.436 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -60.92 -18.8 58.83 Favored 'General case' 0 C--O 1.212 -0.894 0 CA-C-O 120.845 0.355 . . . . 0.0 111.649 176.151 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -118.85 19.51 13.07 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.18 0.592 . . . . 0.0 111.508 178.648 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.403 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 14.0 t80 -66.8 118.48 10.38 Favored 'General case' 0 C--N 1.327 -0.405 0 C-N-CA 122.661 0.384 . . . . 0.0 111.168 -178.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 44.1 mttp -83.13 -26.24 31.16 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 116.003 1.853 . . . . 0.0 116.003 -176.943 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.403 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -64.03 -40.57 96.62 Favored 'General case' 0 C--N 1.326 -0.454 0 C-N-CA 120.614 -0.435 . . . . 0.0 111.564 -175.588 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -133.02 116.2 16.09 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.439 -0.346 . . . . 0.0 110.189 -178.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.9 tptt -57.48 -43.44 84.09 Favored 'General case' 0 C--O 1.21 -1.003 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 178.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -52.3 -45.91 65.74 Favored 'General case' 0 C--N 1.323 -0.572 0 N-CA-C 112.964 0.727 . . . . 0.0 112.964 -178.077 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.8 t -58.52 -44.08 88.36 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.47 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 179.041 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.2 ttp -64.17 -44.31 92.46 Favored 'General case' 0 CA--C 1.51 -0.582 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -63.32 -48.43 78.05 Favored 'General case' 0 C--N 1.322 -0.589 0 C-N-CA 120.746 -0.382 . . . . 0.0 111.849 -179.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 37.0 tptt -71.67 -38.62 70.63 Favored 'General case' 0 C--O 1.221 -0.44 0 C-N-CA 118.315 -1.354 . . . . 0.0 111.961 -178.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.04 -40.04 79.9 Favored 'General case' 0 C--O 1.212 -0.899 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 178.474 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.436 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.64 -51.07 68.7 Favored 'General case' 0 C--N 1.312 -1.031 0 CA-C-N 114.441 -1.254 . . . . 0.0 114.09 178.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.59 -43.6 89.56 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 107.726 -1.213 . . . . 0.0 107.726 -179.377 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 60.3 t -67.86 -51.27 51.8 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.809 0 CA-C-N 116.017 -0.538 . . . . 0.0 111.233 -177.345 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.5 t80 -54.67 -44.87 73.7 Favored 'General case' 0 C--N 1.32 -0.677 0 CA-C-O 120.653 0.263 . . . . 0.0 110.41 -177.488 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 40.5 m -63.81 -38.6 91.72 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 123.641 0.776 . . . . 0.0 111.315 179.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 66.2 mtt180 -61.69 -28.58 69.5 Favored 'General case' 0 C--N 1.32 -0.715 0 O-C-N 121.62 -0.675 . . . . 0.0 111.061 176.285 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.975 HD22 HG21 ' A' ' 508' ' ' VAL . 5.8 mt -76.52 -31.83 57.89 Favored 'General case' 0 CA--C 1.502 -0.891 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 -176.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.25 -38.58 87.21 Favored 'General case' 0 C--O 1.215 -0.749 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.239 177.194 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 16.0 m -74.26 -19.03 60.64 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 113.962 1.097 . . . . 0.0 113.962 178.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 67.2 mtt85 -99.33 -10.01 22.85 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 113.0 0.741 . . . . 0.0 113.0 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -107.36 -169.73 22.05 Favored Glycine 0 C--O 1.227 -0.335 0 CA-C-O 119.802 -0.443 . . . . 0.0 113.476 -174.859 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 1.9 m . . . . . 0 N--CA 1.48 1.051 0 C-N-CA 126.057 1.743 . . . . 0.0 109.919 -179.4 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.618 0 N-CA-C 109.567 -0.531 . . . . 0.0 109.567 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -68.81 150.64 47.6 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 107.23 -1.396 . . . . 0.0 107.23 176.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.5 m -150.97 152.86 32.35 Favored Pre-proline 0 C--N 1.323 -0.577 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 178.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -69.02 148.71 70.44 Favored 'Trans proline' 0 C--O 1.238 0.51 0 C-N-CA 117.626 -1.116 . . . . 0.0 113.017 179.711 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.9 m -67.95 163.72 21.5 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 115.54 -0.755 . . . . 0.0 111.403 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.454 HG13 ' HB3' ' A' ' 506' ' ' LEU . 44.4 t -54.84 -46.92 75.43 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.049 0 O-C-N 122.047 -0.408 . . . . 0.0 111.539 179.502 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.439 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.5 pt-20 -61.03 -34.21 74.5 Favored 'General case' 0 C--N 1.317 -0.827 0 N-CA-C 112.382 0.512 . . . . 0.0 112.382 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -68.19 -41.42 81.44 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 122.15 0.976 . . . . 0.0 108.453 179.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -73.32 -34.89 65.93 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.927 -177.742 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.563 HD21 HG21 ' A' ' 519' ' ' VAL . 2.6 tt -57.57 -37.99 74.09 Favored 'General case' 0 C--O 1.21 -0.985 0 CA-C-N 114.917 -1.038 . . . . 0.0 109.663 178.355 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 13.9 mm-40 -59.36 -38.65 80.97 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.286 -0.565 . . . . 0.0 110.205 179.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -68.44 -53.34 24.24 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 176.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.27 -45.77 87.25 Favored 'General case' 0 C--O 1.216 -0.672 0 N-CA-C 112.623 0.601 . . . . 0.0 112.623 -178.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.423 ' CG ' HG22 ' A' ' 519' ' ' VAL . 17.6 t-160 -58.8 -42.84 90.05 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 -179.686 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 65.7 m -63.59 -41.71 98.33 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 119.573 -0.251 . . . . 0.0 111.195 179.387 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.442 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 60.9 mm-40 -63.79 -40.84 97.63 Favored 'General case' 0 CA--C 1.501 -0.92 0 C-N-CA 120.365 -0.534 . . . . 0.0 111.28 178.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.54 -45.8 71.29 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.039 0 N-CA-C 107.585 -1.265 . . . . 0.0 107.585 177.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 40.5 mtpt -68.08 -39.13 82.99 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -177.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -67.75 -31.38 71.25 Favored 'General case' 0 C--N 1.323 -0.55 0 CA-C-O 120.998 0.428 . . . . 0.0 110.408 178.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -68.06 -18.61 64.72 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 122.633 0.373 . . . . 0.0 111.807 179.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 27.0 mt -107.39 12.16 28.27 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 112.069 0.396 . . . . 0.0 112.069 -177.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -54.91 129.77 38.79 Favored 'General case' 0 C--O 1.209 -1.035 0 N-CA-C 107.054 -1.462 . . . . 0.0 107.054 177.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.0 t -61.25 -40.08 84.79 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.7 0 CA-C-O 122.474 1.13 . . . . 0.0 108.852 178.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 9.3 t70 -66.33 -28.76 68.92 Favored 'General case' 0 C--N 1.318 -0.762 0 CA-C-N 113.398 -1.728 . . . . 0.0 112.676 -179.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 22.9 t -159.59 76.99 2.95 Favored Pre-proline 0 C--O 1.24 0.577 0 N-CA-C 112.295 0.479 . . . . 0.0 112.295 -176.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -73.43 141.61 31.91 Favored 'Trans proline' 0 C--N 1.346 0.407 0 C-N-CA 114.979 -2.881 . . . . 0.0 112.29 177.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 67.3 t0 -137.27 105.1 5.6 Favored 'General case' 0 C--N 1.323 -0.549 0 CA-C-O 121.491 0.662 . . . . 0.0 110.444 179.956 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -60.81 -44.18 96.99 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.005 0 N-CA-C 112.792 0.664 . . . . 0.0 112.792 -179.555 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.8 mttt -58.71 -32.69 69.41 Favored 'General case' 0 CA--C 1.507 -0.693 0 N-CA-C 109.681 -0.488 . . . . 0.0 109.681 -178.388 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 22.7 ttp180 -68.51 -41.0 80.59 Favored 'General case' 0 C--N 1.321 -0.64 0 N-CA-C 109.307 -0.627 . . . . 0.0 109.307 -177.317 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.429 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -68.0 -48.98 64.27 Favored 'General case' 0 C--O 1.216 -0.686 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 177.624 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 90.8 mt -56.89 -44.07 81.95 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 111.806 0.299 . . . . 0.0 111.806 -176.526 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -61.91 -38.22 87.57 Favored 'General case' 0 C--N 1.325 -0.5 0 CA-C-O 121.654 0.74 . . . . 0.0 111.704 179.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.442 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -70.93 -47.46 58.93 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-O 121.499 0.666 . . . . 0.0 109.704 178.382 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.429 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.93 -47.89 73.83 Favored 'General case' 0 N--CA 1.428 -1.537 0 CA-C-N 115.395 -0.82 . . . . 0.0 111.115 178.743 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 -61.4 -35.74 78.34 Favored 'General case' 0 C--N 1.324 -0.52 0 N-CA-C 113.434 0.902 . . . . 0.0 113.434 -175.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.65 -46.13 59.93 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 177.42 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.49 -33.87 68.48 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-O 121.337 0.589 . . . . 0.0 109.872 -178.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.64 -16.65 68.05 Favored Glycine 0 C--O 1.239 0.429 0 N-CA-C 115.034 0.774 . . . . 0.0 115.034 179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.4 t -112.76 -7.93 13.78 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 118.136 0.968 . . . . 0.0 111.017 179.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.454 ' HB3' HG13 ' A' ' 471' ' ' VAL . 3.7 mt -71.89 148.93 45.62 Favored 'General case' 0 C--N 1.325 -0.483 0 N-CA-C 109.808 -0.441 . . . . 0.0 109.808 179.419 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.424 ' O ' HD13 ' A' ' 512' ' ' ILE . 26.1 tt0 -79.4 84.33 5.32 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 122.757 1.265 . . . . 0.0 109.452 178.027 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.889 HG21 HD22 ' A' ' 546' ' ' LEU . 30.2 m -98.3 48.3 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.42 0 CA-C-O 123.028 1.394 . . . . 0.0 107.93 -178.517 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.0 t -66.24 172.44 3.89 Favored 'General case' 0 C--N 1.315 -0.903 0 N-CA-C 107.078 -1.452 . . . . 0.0 107.078 -178.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 20.2 m -49.32 -33.25 12.84 Favored 'General case' 0 C--O 1.212 -0.915 0 N-CA-C 113.211 0.819 . . . . 0.0 113.211 -174.166 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -55.48 -44.35 76.4 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 112.25 0.463 . . . . 0.0 112.25 178.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.424 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -86.63 -41.4 14.89 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 CA-C-O 121.502 0.668 . . . . 0.0 109.348 179.119 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.455 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.35 -38.47 80.48 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.566 0.58 . . . . 0.0 112.566 -176.054 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 15.8 pt20 -63.85 -31.37 72.52 Favored 'General case' 0 N--CA 1.468 0.474 0 CA-C-O 121.641 0.734 . . . . 0.0 112.446 -178.484 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.5 ptmt -95.38 -5.87 42.29 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.181 -0.918 . . . . 0.0 112.447 -179.856 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 9.6 m120 -127.91 39.25 3.89 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.465 0.65 . . . . 0.0 111.296 -178.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.8 p -62.56 -25.48 68.08 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 -178.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -63.36 -31.78 73.02 Favored 'General case' 0 N--CA 1.469 0.498 0 CA-C-O 121.424 0.631 . . . . 0.0 112.155 178.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.563 HG21 HD21 ' A' ' 475' ' ' LEU . 41.3 t -71.15 -40.87 75.44 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.667 0 N-CA-C 107.775 -1.194 . . . . 0.0 107.775 179.354 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.4 t -62.5 -37.75 79.63 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 178.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.23 -38.69 92.17 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.38 177.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.5 m -73.68 -37.99 65.05 Favored 'General case' 0 C--O 1.219 -0.512 0 CA-C-N 118.383 0.538 . . . . 0.0 110.536 -179.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.686 HD23 HD11 ' A' ' 526' ' ' ILE . 68.6 mt -59.36 -34.51 72.49 Favored 'General case' 0 C--N 1.319 -0.721 0 CA-C-O 120.929 0.395 . . . . 0.0 110.815 178.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -65.57 -29.04 69.6 Favored 'General case' 0 CA--C 1.538 0.516 0 O-C-N 121.807 -0.558 . . . . 0.0 111.212 175.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 71.2 mttt -71.21 -45.88 62.38 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 120.816 0.341 . . . . 0.0 110.986 179.188 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.686 HD11 HD23 ' A' ' 523' ' ' LEU . 5.3 pt -78.79 -20.4 12.98 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.987 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -177.391 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.446 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.97 -12.48 38.08 Favored 'General case' 0 C--O 1.214 -0.802 0 O-C-N 121.678 -0.638 . . . . 0.0 112.537 176.919 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -118.83 15.78 13.47 Favored 'General case' 0 N--CA 1.47 0.547 0 C-N-CA 122.527 0.331 . . . . 0.0 111.57 174.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.411 ' CE2' ' HB3' ' A' ' 531' ' ' ALA . 18.2 t80 -63.32 122.85 17.21 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.203 0.525 . . . . 0.0 112.005 -176.749 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 37.2 mmtm -92.38 -26.3 18.11 Favored 'General case' 0 C--O 1.218 -0.593 0 N-CA-C 116.484 2.031 . . . . 0.0 116.484 -177.378 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.411 ' HB3' ' CE2' ' A' ' 529' ' ' TYR . . . -62.7 -42.29 99.56 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-O 121.719 0.771 . . . . 0.0 110.559 -176.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.5 m120 -129.6 111.88 13.15 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 108.1 -1.074 . . . . 0.0 108.1 179.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 12.9 tttt -61.02 -38.05 84.73 Favored 'General case' 0 C--O 1.209 -1.038 0 C-N-CA 120.846 -0.341 . . . . 0.0 110.731 -179.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -57.15 -41.96 80.11 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -178.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 55.0 t -56.45 -43.28 77.4 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.557 0 N-CA-C 109.409 -0.589 . . . . 0.0 109.409 177.548 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 6.9 ttp -66.47 -40.11 89.17 Favored 'General case' 0 C--N 1.323 -0.58 0 C-N-CA 122.369 0.268 . . . . 0.0 110.759 179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.24 -51.38 63.92 Favored 'General case' 0 C--N 1.32 -0.694 0 O-C-N 123.086 0.241 . . . . 0.0 110.368 179.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.5 tptt -70.16 -38.29 75.42 Favored 'General case' 0 C--O 1.219 -0.533 0 C-N-CA 119.401 -0.92 . . . . 0.0 111.239 -177.616 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . 0.463 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -58.35 -40.71 82.92 Favored 'General case' 0 C--O 1.213 -0.868 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 178.465 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.446 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.51 -47.79 74.75 Favored 'General case' 0 C--N 1.313 -1.005 0 CA-C-N 114.896 -1.047 . . . . 0.0 112.854 179.294 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.4 -42.59 92.13 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.029 -0.73 . . . . 0.0 109.029 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 54.1 t -70.59 -49.72 50.2 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.085 0 C-N-CA 122.883 0.473 . . . . 0.0 111.61 -177.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -55.63 -44.97 77.62 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 109.914 -0.402 . . . . 0.0 109.914 -178.064 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.3 m -66.71 -36.29 82.15 Favored 'General case' 0 C--N 1.325 -0.478 0 C-N-CA 122.792 0.437 . . . . 0.0 110.889 179.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 9.3 mtt85 -58.84 -30.21 67.51 Favored 'General case' 0 C--N 1.325 -0.474 0 O-C-N 121.979 -0.451 . . . . 0.0 110.263 175.245 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.889 HD22 HG21 ' A' ' 508' ' ' VAL . 8.7 mt -76.63 -34.79 58.32 Favored 'General case' 0 CA--C 1.497 -1.088 0 N-CA-C 107.836 -1.172 . . . . 0.0 107.836 -176.064 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.66 -30.45 70.73 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-N 115.3 -0.864 . . . . 0.0 111.674 179.65 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 25.3 m -78.01 -10.21 59.49 Favored 'General case' 0 C--N 1.318 -0.796 0 CA-C-N 115.803 -0.635 . . . . 0.0 112.428 177.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 79.5 mtt85 -110.8 -27.42 8.87 Favored 'General case' 0 N--CA 1.473 0.699 0 N-CA-C 113.009 0.744 . . . . 0.0 113.009 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -167.09 161.76 35.59 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 121.471 -0.395 . . . . 0.0 112.524 -178.379 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 9.5 m . . . . . 0 C--O 1.243 0.742 0 CA-C-O 117.702 -1.142 . . . . 0.0 112.864 -178.158 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 N-CA-C 109.774 -0.454 . . . . 0.0 109.774 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -152.44 172.18 16.92 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 104.899 -2.26 . . . . 0.0 104.899 179.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 44.7 p -77.47 150.73 79.96 Favored Pre-proline 0 C--N 1.323 -0.555 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 177.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -67.74 156.02 67.66 Favored 'Trans proline' 0 C--O 1.238 0.485 0 C-N-CA 118.205 -0.73 . . . . 0.0 112.787 178.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 9.2 m -67.26 162.16 23.29 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 115.762 -0.654 . . . . 0.0 112.245 -178.176 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.403 HG13 ' HB3' ' A' ' 506' ' ' LEU . 41.9 t -53.9 -46.75 64.59 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 179.389 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.429 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.6 pt-20 -62.09 -34.16 75.79 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-O 120.74 0.305 . . . . 0.0 111.566 -177.536 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -68.47 -41.9 79.49 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 108.114 -1.069 . . . . 0.0 108.114 179.565 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 54.6 mtpt -73.17 -34.09 65.83 Favored 'General case' 0 CA--C 1.508 -0.656 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.281 -176.947 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.552 HD21 HG21 ' A' ' 519' ' ' VAL . 3.0 tt -58.95 -35.87 73.87 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-N 115.037 -0.983 . . . . 0.0 109.481 178.119 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -59.11 -40.18 84.56 Favored 'General case' 0 C--N 1.325 -0.462 0 C-N-CA 119.906 -0.718 . . . . 0.0 109.647 178.629 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 63.6 tttp -67.29 -54.16 23.25 Favored 'General case' 0 C--O 1.219 -0.545 0 C-N-CA 120.509 -0.476 . . . . 0.0 110.151 177.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.59 -45.18 81.53 Favored 'General case' 0 C--O 1.22 -0.477 0 N-CA-C 112.901 0.704 . . . . 0.0 112.901 -179.499 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.402 ' CG ' HG22 ' A' ' 519' ' ' VAL . 18.8 t-160 -58.89 -41.8 88.03 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 108.924 -0.769 . . . . 0.0 108.924 179.373 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 57.4 m -65.3 -39.31 92.34 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 119.406 -0.331 . . . . 0.0 111.649 179.092 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.506 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 58.5 mm-40 -64.49 -41.01 96.71 Favored 'General case' 0 CA--C 1.512 -0.483 0 C-N-CA 120.09 -0.644 . . . . 0.0 109.846 178.415 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.7 mt -54.88 -47.22 75.78 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.214 0 N-CA-C 107.671 -1.233 . . . . 0.0 107.671 177.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 44.0 mtpt -65.79 -38.43 88.98 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 113.005 0.743 . . . . 0.0 113.005 -177.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 26.0 m-85 -67.3 -34.01 76.49 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 120.866 0.365 . . . . 0.0 110.414 177.788 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.6 -17.45 64.83 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 112.902 0.704 . . . . 0.0 112.902 -179.715 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.0 mt -107.28 11.93 28.71 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.414 0.524 . . . . 0.0 112.414 -177.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 18.4 mtpp -57.2 129.69 42.88 Favored 'General case' 0 CA--C 1.497 -1.081 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 177.359 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 16.1 m -71.32 -19.53 20.84 Favored 'Isoleucine or valine' 0 CA--C 1.497 -1.079 0 CA-C-N 114.828 -1.078 . . . . 0.0 110.942 -178.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -82.84 -27.91 30.51 Favored 'General case' 0 N--CA 1.431 -1.409 0 CA-C-N 113.47 -1.695 . . . . 0.0 110.823 -179.562 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 77.4 p -163.76 79.19 1.57 Allowed Pre-proline 0 C--O 1.241 0.623 0 CA-C-N 115.954 -0.566 . . . . 0.0 111.897 -176.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 89.8 Cg_endo -73.49 147.84 41.68 Favored 'Trans proline' 0 CA--C 1.532 0.413 0 C-N-CA 115.493 -2.538 . . . . 0.0 112.782 179.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.1 t0 -137.28 100.09 4.16 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.751 0.786 . . . . 0.0 109.726 179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.425 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.4 OUTLIER -60.5 -47.6 91.97 Favored 'Isoleucine or valine' 0 CA--C 1.503 -0.838 0 N-CA-C 113.522 0.934 . . . . 0.0 113.522 -177.666 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 61.3 mttm -60.69 -30.15 69.75 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 109.822 -0.436 . . . . 0.0 109.822 -177.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.2 ttt180 -68.32 -41.59 80.62 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 -178.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.448 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.38 -47.74 78.1 Favored 'General case' 0 C--O 1.215 -0.749 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 176.17 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 86.2 mt -57.37 -44.47 84.45 Favored 'General case' 0 N--CA 1.471 0.615 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -176.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.22 -38.49 89.4 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-O 121.772 0.796 . . . . 0.0 110.115 179.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.506 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.16 -48.32 62.58 Favored 'General case' 0 C--N 1.321 -0.631 0 O-C-N 121.693 -0.629 . . . . 0.0 110.078 179.419 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.448 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -56.18 -48.25 76.72 Favored 'General case' 0 N--CA 1.432 -1.368 0 CA-C-N 115.583 -0.735 . . . . 0.0 110.882 178.255 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.3 pt-20 -62.15 -35.71 79.61 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 112.977 0.732 . . . . 0.0 112.977 -175.404 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 2.8 tt0 -72.78 -43.09 63.24 Favored 'General case' 0 C--N 1.331 -0.212 0 C-N-CA 119.02 -1.072 . . . . 0.0 108.602 177.256 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.48 -35.82 70.67 Favored 'General case' 0 CA--C 1.537 0.444 0 CA-C-O 121.237 0.541 . . . . 0.0 110.325 -179.477 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.8 -18.81 68.85 Favored Glycine 0 C--O 1.242 0.602 0 N-CA-C 114.996 0.758 . . . . 0.0 114.996 -179.895 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.8 t -109.27 -10.31 14.96 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 117.717 0.758 . . . . 0.0 110.293 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.403 ' HB3' HG13 ' A' ' 471' ' ' VAL . 1.4 mt -71.16 148.89 46.92 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 178.797 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.452 ' O ' HD13 ' A' ' 512' ' ' ILE . 32.6 tt0 -79.76 84.26 5.59 Favored 'General case' 0 C--O 1.216 -0.703 0 CA-C-O 122.261 1.029 . . . . 0.0 109.264 178.476 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.921 HG21 HD22 ' A' ' 546' ' ' LEU . 35.5 m -98.54 47.73 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.309 -1.163 0 CA-C-O 123.344 1.545 . . . . 0.0 108.188 -178.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 13.3 t -68.16 173.73 4.47 Favored 'General case' 0 C--N 1.315 -0.925 0 N-CA-C 106.607 -1.627 . . . . 0.0 106.607 -179.253 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.5 m -49.37 -33.76 14.41 Favored 'General case' 0 C--O 1.215 -0.738 0 N-CA-C 114.021 1.119 . . . . 0.0 114.021 -173.09 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -53.91 -43.43 69.72 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 111.807 0.299 . . . . 0.0 111.807 177.62 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.452 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.2 mp -88.63 -41.77 14.31 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.672 0 CA-C-O 121.979 0.895 . . . . 0.0 109.431 179.371 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.82 -39.47 81.3 Favored 'General case' 0 C--N 1.314 -0.946 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -175.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 -67.55 -32.43 73.19 Favored 'General case' 0 C--N 1.322 -0.607 0 CA-C-N 116.324 -0.398 . . . . 0.0 111.649 -178.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -89.11 -10.02 48.89 Favored 'General case' 0 N--CA 1.469 0.5 0 C-N-CA 120.935 -0.306 . . . . 0.0 111.202 179.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 11.0 m120 -125.65 40.99 3.62 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.484 0.659 . . . . 0.0 112.163 -176.113 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 23.8 p -63.51 -24.45 67.82 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 112.808 0.67 . . . . 0.0 112.808 -179.166 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -62.15 -31.82 72.36 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.022 0.439 . . . . 0.0 112.024 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.552 HG21 HD21 ' A' ' 475' ' ' LEU . 23.6 t -71.11 -40.27 75.11 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.611 0 N-CA-C 108.13 -1.063 . . . . 0.0 108.13 179.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 49.0 t -62.56 -36.83 76.93 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 178.193 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.82 -37.52 87.7 Favored 'General case' 0 C--N 1.325 -0.48 0 CA-C-N 116.459 -0.337 . . . . 0.0 110.825 177.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.5 m -75.89 -38.38 57.87 Favored 'General case' 0 C--O 1.218 -0.555 0 CA-C-N 118.531 0.605 . . . . 0.0 110.017 -179.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.507 HD23 HD11 ' A' ' 526' ' ' ILE . 46.4 mt -57.78 -34.96 70.16 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 120.951 0.405 . . . . 0.0 111.417 178.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.6 mtmt -65.33 -29.09 69.79 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 121.976 -0.453 . . . . 0.0 111.376 175.721 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -73.7 -44.32 56.82 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-O 120.733 0.301 . . . . 0.0 111.189 179.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.507 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.23 -22.14 13.46 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.877 0 N-CA-C 114.323 1.231 . . . . 0.0 114.323 -176.783 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.41 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -62.6 -16.03 54.4 Favored 'General case' 0 C--O 1.214 -0.793 0 N-CA-C 112.373 0.509 . . . . 0.0 112.373 176.555 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.2 ptm180 -118.65 19.28 13.27 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.044 0.538 . . . . 0.0 111.61 177.568 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 21.5 t80 -69.5 95.11 0.8 Allowed 'General case' 0 C--N 1.325 -0.468 0 N-CA-C 112.966 0.728 . . . . 0.0 112.966 -177.505 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -63.64 -27.59 69.34 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 114.718 1.377 . . . . 0.0 114.718 -178.122 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -63.5 -31.06 72.11 Favored 'General case' 0 C--O 1.22 -0.457 0 N-CA-C 112.384 0.513 . . . . 0.0 112.384 -176.098 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 8.4 m-80 -144.77 108.24 4.63 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 109.905 -0.406 . . . . 0.0 109.905 -179.326 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.7 tptt -53.96 -46.27 71.57 Favored 'General case' 0 C--O 1.208 -1.112 0 CA-C-N 115.76 -0.655 . . . . 0.0 111.043 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.2 t0 -55.92 -43.42 77.35 Favored 'General case' 0 C--N 1.322 -0.594 0 CA-C-O 121.038 0.446 . . . . 0.0 111.992 -176.66 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.3 t -57.53 -44.76 85.54 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.491 0 N-CA-C 109.754 -0.461 . . . . 0.0 109.754 177.575 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.3 ttp -64.72 -42.85 94.93 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 119.283 -0.389 . . . . 0.0 110.279 -179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -64.52 -48.36 75.41 Favored 'General case' 0 C--N 1.323 -0.572 0 C-N-CA 120.545 -0.462 . . . . 0.0 111.828 179.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 32.0 tptt -68.88 -39.16 79.96 Favored 'General case' 0 C--O 1.22 -0.474 0 C-N-CA 118.978 -1.089 . . . . 0.0 110.908 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.94 -40.18 83.84 Favored 'General case' 0 C--O 1.216 -0.704 0 N-CA-C 109.084 -0.709 . . . . 0.0 109.084 177.954 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -65.99 -48.21 71.99 Favored 'General case' 0 C--N 1.316 -0.859 0 CA-C-N 115.614 -0.721 . . . . 0.0 112.868 179.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.01 -42.12 93.64 Favored 'General case' 0 C--N 1.321 -0.636 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 -179.823 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 56.9 t -70.52 -51.43 37.56 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.921 0 CA-C-N 115.959 -0.564 . . . . 0.0 111.578 -178.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 48.4 t80 -54.07 -44.84 71.46 Favored 'General case' 0 C--N 1.322 -0.619 0 N-CA-C 110.403 -0.221 . . . . 0.0 110.403 -177.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.7 m -66.17 -34.84 78.96 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 123.111 0.564 . . . . 0.0 111.638 179.49 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 26.1 mtt85 -62.45 -31.18 71.86 Favored 'General case' 0 C--O 1.217 -0.648 0 O-C-N 121.771 -0.581 . . . . 0.0 109.698 175.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.921 HD22 HG21 ' A' ' 508' ' ' VAL . 5.7 mt -75.03 -34.69 61.91 Favored 'General case' 0 CA--C 1.504 -0.797 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 -176.376 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -59.79 -33.43 71.71 Favored 'General case' 0 C--O 1.215 -0.726 0 CA-C-N 115.042 -0.981 . . . . 0.0 109.392 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.3 m -81.6 -16.12 52.53 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.034 0.753 . . . . 0.0 113.034 179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 93.6 mtt-85 -97.65 -15.14 20.56 Favored 'General case' 0 N--CA 1.474 0.749 0 O-C-N 122.21 -0.306 . . . . 0.0 111.758 179.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -158.21 -90.7 0.08 OUTLIER Glycine 0 C--O 1.227 -0.326 0 C-N-CA 121.26 -0.495 . . . . 0.0 112.972 -177.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 C--O 1.25 1.119 0 CA-C-O 115.694 -2.098 . . . . 0.0 105.602 -179.243 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.746 0 CA-C-O 118.528 -0.749 . . . . 0.0 109.461 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 54.14 42.48 31.54 Favored 'General case' 0 N--CA 1.473 0.685 0 O-C-N 123.954 0.784 . . . . 0.0 109.663 -177.175 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 5.1 m -122.33 71.93 36.6 Favored Pre-proline 0 C--N 1.327 -0.409 0 CA-C-N 115.473 -0.785 . . . . 0.0 111.198 -177.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -69.09 156.15 65.96 Favored 'Trans proline' 0 C--O 1.24 0.611 0 C-N-CA 118.2 -0.734 . . . . 0.0 113.048 -179.227 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.1 m -66.75 165.21 15.5 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-N 115.534 -0.757 . . . . 0.0 112.145 -178.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.46 HG13 ' HB3' ' A' ' 506' ' ' LEU . 53.3 t -56.08 -47.23 80.74 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.771 0 N-CA-C 112.011 0.374 . . . . 0.0 112.011 -179.88 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.4 pt-20 -64.08 -34.24 77.58 Favored 'General case' 0 C--N 1.318 -0.778 0 N-CA-C 111.862 0.319 . . . . 0.0 111.862 -178.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -67.27 -43.64 81.33 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.991 0.901 . . . . 0.0 108.783 177.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 24.8 mttt -69.04 -34.27 74.94 Favored 'General case' 0 CA--C 1.5 -0.944 0 CA-C-N 115.46 -0.791 . . . . 0.0 110.0 -178.144 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.412 HD21 HG21 ' A' ' 519' ' ' VAL . 1.5 tm? -58.63 -36.98 74.93 Favored 'General case' 0 N--CA 1.441 -0.919 0 CA-C-N 114.99 -1.004 . . . . 0.0 109.355 179.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -54.92 -40.78 70.23 Favored 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.243 -0.583 . . . . 0.0 110.04 -179.871 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 62.6 tttt -68.97 -55.06 12.06 Favored 'General case' 0 C--O 1.218 -0.585 0 N-CA-C 109.657 -0.498 . . . . 0.0 109.657 176.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.23 -46.87 79.37 Favored 'General case' 0 C--O 1.218 -0.594 0 N-CA-C 114.164 1.172 . . . . 0.0 114.164 -176.357 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -60.88 -40.61 93.65 Favored 'General case' 0 C--N 1.318 -0.765 0 N-CA-C 108.994 -0.743 . . . . 0.0 108.994 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 55.0 m -63.98 -41.89 97.39 Favored 'General case' 0 C--O 1.222 -0.363 0 C-N-CA 120.755 -0.378 . . . . 0.0 110.549 179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.46 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.5 mm-40 -63.12 -42.89 99.61 Favored 'General case' 0 CA--C 1.507 -0.683 0 CA-C-N 118.004 0.365 . . . . 0.0 110.872 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.63 -47.49 72.49 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.239 0 N-CA-C 107.814 -1.18 . . . . 0.0 107.814 177.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 45.6 mtpt -67.2 -37.32 83.47 Favored 'General case' 0 C--N 1.32 -0.703 0 N-CA-C 113.086 0.773 . . . . 0.0 113.086 -177.079 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 19.2 m-85 -67.15 -33.73 76.05 Favored 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 109.972 -0.381 . . . . 0.0 109.972 177.569 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.0 -17.36 64.89 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 112.392 0.515 . . . . 0.0 112.392 179.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 27.9 mt -107.06 12.08 28.94 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 112.428 0.529 . . . . 0.0 112.428 -179.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 23.5 mttt -56.05 132.42 50.05 Favored 'General case' 0 C--O 1.21 -1.006 0 N-CA-C 107.01 -1.478 . . . . 0.0 107.01 177.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.0 t -63.84 -41.1 91.41 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.771 0 N-CA-C 107.454 -1.313 . . . . 0.0 107.454 175.645 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 29.2 t70 -65.55 -28.76 69.39 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 113.056 -1.884 . . . . 0.0 113.782 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 19.0 m -159.93 72.85 3.15 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 113.025 0.75 . . . . 0.0 113.025 -176.189 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 95.5 Cg_endo -74.41 141.49 28.58 Favored 'Trans proline' 0 CA--C 1.534 0.494 0 C-N-CA 114.18 -3.413 . . . . 0.0 112.27 179.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 68.0 t0 -137.27 100.15 4.17 Favored 'General case' 0 C--N 1.325 -0.497 0 CA-C-O 121.579 0.704 . . . . 0.0 110.214 -178.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.416 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.3 OUTLIER -58.16 -46.55 88.43 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.765 0 N-CA-C 113.052 0.76 . . . . 0.0 113.052 -178.433 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 93.2 mttt -57.87 -31.93 67.19 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 110.06 -0.348 . . . . 0.0 110.06 -178.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.9 ttt180 -70.82 -39.88 72.79 Favored 'General case' 0 C--N 1.32 -0.677 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 -176.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.42 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.42 -48.61 72.21 Favored 'General case' 0 C--O 1.217 -0.657 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 175.921 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.6 mt -56.83 -42.94 80.52 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -176.252 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.3 t-20 -65.0 -38.44 90.97 Favored 'General case' 0 C--N 1.324 -0.528 0 CA-C-O 121.424 0.63 . . . . 0.0 111.836 179.468 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.46 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -68.42 -47.53 67.01 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 121.579 0.704 . . . . 0.0 109.582 178.224 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.42 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -55.07 -48.11 73.95 Favored 'General case' 0 N--CA 1.428 -1.53 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.875 177.743 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -63.96 -34.12 77.26 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 113.775 1.028 . . . . 0.0 113.775 -175.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.8 tt0 -69.56 -46.88 65.37 Favored 'General case' 0 C--O 1.224 -0.241 0 N-CA-C 107.304 -1.369 . . . . 0.0 107.304 176.295 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.408 HD21 HD23 ' A' ' 475' ' ' LEU . 1.1 tm? -58.44 -33.6 69.89 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 121.191 0.52 . . . . 0.0 110.901 -178.754 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.81 -18.29 63.95 Favored Glycine 0 C--O 1.235 0.191 0 CA-C-O 119.451 -0.638 . . . . 0.0 114.359 179.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.1 t -111.36 -12.44 14.04 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 117.911 0.856 . . . . 0.0 110.466 -179.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.46 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.9 mt -68.87 146.48 52.79 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.982 -0.448 . . . . 0.0 110.228 179.452 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.416 ' O ' HD13 ' A' ' 512' ' ' ILE . 36.5 tt0 -79.22 84.4 5.18 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 122.762 1.267 . . . . 0.0 110.21 178.692 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.898 HG21 HD22 ' A' ' 546' ' ' LEU . 27.0 m -96.19 45.8 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.306 -1.293 0 CA-C-O 122.8 1.286 . . . . 0.0 109.11 -178.547 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.1 t -66.47 171.31 5.08 Favored 'General case' 0 C--N 1.316 -0.889 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 -177.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.5 m -49.26 -30.19 6.9 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 113.966 1.098 . . . . 0.0 113.966 -174.51 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -55.43 -45.71 76.76 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-O 120.522 0.201 . . . . 0.0 111.475 176.629 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.416 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -88.75 -40.3 13.23 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.371 0 CA-C-O 121.283 0.563 . . . . 0.0 109.819 179.688 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.499 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.91 -34.93 75.42 Favored 'General case' 0 N--CA 1.443 -0.796 0 N-CA-C 112.981 0.734 . . . . 0.0 112.981 -174.941 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.4 pt20 -64.62 -31.68 73.01 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-O 121.786 0.803 . . . . 0.0 111.817 -179.455 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -95.34 -3.04 47.97 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.899 -179.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 4.5 m120 -126.19 38.91 4.05 Favored 'General case' 0 CA--C 1.543 0.677 0 CA-C-O 121.163 0.506 . . . . 0.0 110.526 -179.233 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.5 p -63.81 -29.27 70.49 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 113.35 0.87 . . . . 0.0 113.35 -178.372 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 13.9 m-20 -63.58 -26.74 68.83 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-O 121.586 0.708 . . . . 0.0 111.83 177.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.412 HG21 HD21 ' A' ' 475' ' ' LEU . 38.4 t -71.66 -42.85 71.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.722 0 N-CA-C 107.654 -1.239 . . . . 0.0 107.654 -179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 40.2 t -62.82 -35.96 73.31 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.551 0 N-CA-C 107.563 -1.273 . . . . 0.0 107.563 179.429 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.92 -37.11 85.69 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.06 176.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 98.0 m -77.91 -38.54 45.44 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-N 118.958 0.799 . . . . 0.0 110.011 -179.503 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.531 HD23 HD11 ' A' ' 526' ' ' ILE . 45.0 mt -57.52 -35.13 69.87 Favored 'General case' 0 C--N 1.32 -0.709 0 CA-C-O 121.01 0.433 . . . . 0.0 111.393 178.776 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.7 mtmt -64.95 -29.03 69.93 Favored 'General case' 0 CA--C 1.539 0.539 0 O-C-N 121.948 -0.47 . . . . 0.0 111.538 175.567 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 80.3 mttt -73.43 -45.14 56.26 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 120.768 0.318 . . . . 0.0 111.259 179.303 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.531 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -77.06 -23.4 14.82 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.923 0 N-CA-C 114.405 1.261 . . . . 0.0 114.405 -176.405 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.439 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.2 OUTLIER -60.2 -19.32 53.69 Favored 'General case' 0 C--O 1.211 -0.93 0 N-CA-C 112.147 0.425 . . . . 0.0 112.147 176.413 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.5 ptm180 -118.64 19.32 13.27 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 123.093 0.557 . . . . 0.0 111.897 177.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -63.59 109.68 1.74 Allowed 'General case' 0 C--O 1.221 -0.4 0 N-CA-C 112.905 0.705 . . . . 0.0 112.905 -176.501 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.7 mttt -72.51 -29.27 63.46 Favored 'General case' 0 C--O 1.218 -0.554 0 N-CA-C 115.022 1.49 . . . . 0.0 115.022 -177.691 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.65 -24.84 64.58 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 113.299 0.852 . . . . 0.0 113.299 -174.333 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -150.79 119.25 6.44 Favored 'General case' 0 C--N 1.326 -0.416 0 C-N-CA 120.774 -0.371 . . . . 0.0 110.422 178.26 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 39.8 tptt -61.38 -45.94 92.27 Favored 'General case' 0 C--O 1.21 -0.999 0 CA-C-N 115.963 -0.562 . . . . 0.0 112.121 -177.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 8.2 t0 -56.89 -40.36 76.1 Favored 'General case' 0 C--N 1.323 -0.568 0 CA-C-O 121.185 0.517 . . . . 0.0 111.515 -175.396 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.7 t -56.05 -45.09 80.34 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.537 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 176.767 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.2 ttp -64.55 -43.93 92.37 Favored 'General case' 0 CA--C 1.511 -0.529 0 CA-C-O 119.12 -0.467 . . . . 0.0 110.08 179.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -64.54 -47.59 78.21 Favored 'General case' 0 C--N 1.323 -0.566 0 C-N-CA 120.305 -0.558 . . . . 0.0 111.99 -179.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.6 tptt -68.72 -40.28 80.0 Favored 'General case' 0 C--O 1.222 -0.39 0 C-N-CA 119.627 -0.829 . . . . 0.0 110.934 -178.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.85 -39.94 86.89 Favored 'General case' 0 C--O 1.213 -0.852 0 N-CA-C 109.202 -0.666 . . . . 0.0 109.202 178.825 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.439 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.12 -48.79 74.71 Favored 'General case' 0 C--N 1.314 -0.943 0 CA-C-N 115.354 -0.839 . . . . 0.0 113.15 179.087 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.05 -43.96 95.0 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.714 -0.847 . . . . 0.0 108.714 179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 59.0 t -68.69 -50.13 58.14 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.861 0 CA-C-N 116.534 -0.303 . . . . 0.0 111.676 -178.253 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -54.68 -45.03 73.85 Favored 'General case' 0 C--N 1.321 -0.639 0 CA-C-O 120.657 0.265 . . . . 0.0 110.374 -177.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 10.3 m -67.15 -34.13 76.92 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-O 120.755 0.312 . . . . 0.0 111.273 179.773 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 3.1 mpt_? -60.76 -28.94 69.09 Favored 'General case' 0 C--N 1.325 -0.482 0 O-C-N 121.613 -0.68 . . . . 0.0 109.732 175.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.898 HD22 HG21 ' A' ' 508' ' ' VAL . 9.2 mt -76.39 -34.24 58.87 Favored 'General case' 0 CA--C 1.495 -1.14 0 N-CA-C 107.655 -1.239 . . . . 0.0 107.655 -174.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.86 -29.09 70.48 Favored 'General case' 0 C--O 1.217 -0.635 0 CA-C-N 114.656 -1.156 . . . . 0.0 111.418 178.478 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 21.6 m -79.63 -8.6 59.31 Favored 'General case' 0 C--N 1.317 -0.827 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.456 176.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 74.0 mtt85 -113.65 -25.63 8.62 Favored 'General case' 0 N--CA 1.475 0.801 0 N-CA-C 113.033 0.753 . . . . 0.0 113.033 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -161.14 162.41 33.67 Favored Glycine 0 N--CA 1.453 -0.221 0 N-CA-C 110.417 -1.073 . . . . 0.0 110.417 -178.525 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 11.2 m . . . . . 0 C--O 1.243 0.75 0 CA-C-O 118.261 -0.876 . . . . 0.0 113.134 -177.06 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.704 0 CA-C-O 119.0 -0.524 . . . . 0.0 109.624 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -67.36 -33.19 74.72 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 117.841 0.291 . . . . 0.0 111.518 -179.652 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 15.4 m 46.73 58.98 16.63 Favored Pre-proline 0 N--CA 1.474 0.756 0 N-CA-C 114.579 1.326 . . . . 0.0 114.579 -179.989 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 94.2 Cg_endo -70.74 161.12 47.16 Favored 'Trans proline' 0 C--N 1.349 0.592 0 N-CA-C 114.986 1.11 . . . . 0.0 114.986 -177.441 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 8.9 m -68.7 163.86 22.96 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.342 -0.845 . . . . 0.0 113.091 -178.768 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 35.6 t -53.86 -47.13 64.14 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.132 0 N-CA-C 112.813 0.671 . . . . 0.0 112.813 179.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.402 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.1 pt-20 -64.7 -34.31 78.01 Favored 'General case' 0 C--N 1.317 -0.846 0 CA-C-O 120.718 0.294 . . . . 0.0 111.41 -176.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -67.25 -41.33 85.78 Favored 'General case' 0 C--N 1.323 -0.569 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 177.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -73.27 -33.61 65.35 Favored 'General case' 0 CA--C 1.51 -0.592 0 CA-C-N 115.119 -0.946 . . . . 0.0 110.891 -176.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.488 HD21 HG21 ' A' ' 519' ' ' VAL . 5.0 tt -56.74 -35.58 68.77 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 114.865 -1.061 . . . . 0.0 110.005 178.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 74.0 mt-30 -55.5 -41.02 72.49 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.253 0.479 . . . . 0.0 110.634 179.38 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -66.38 -54.68 21.59 Favored 'General case' 0 C--O 1.22 -0.481 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 177.376 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.67 -47.23 85.18 Favored 'General case' 0 C--O 1.218 -0.582 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -176.505 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.477 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.6 t-160 -58.98 -43.08 91.34 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 109.488 -0.56 . . . . 0.0 109.488 -179.706 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 62.2 m -64.13 -39.03 93.16 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 117.752 0.251 . . . . 0.0 111.619 -178.922 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.401 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.3 mm-40 -64.23 -37.26 86.84 Favored 'General case' 0 CA--C 1.501 -0.935 0 C-N-CA 120.62 -0.432 . . . . 0.0 110.595 179.001 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -58.14 -44.0 86.62 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.993 0 N-CA-C 106.944 -1.502 . . . . 0.0 106.944 178.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 21.3 mmtt -62.94 -43.08 99.76 Favored 'General case' 0 N--CA 1.48 1.044 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.606 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 37.4 m-85 -67.59 -34.12 76.38 Favored 'General case' 0 N--CA 1.469 0.521 0 CA-C-O 120.73 0.3 . . . . 0.0 111.02 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.84 -15.29 63.52 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 112.666 0.617 . . . . 0.0 112.666 -178.994 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 29.7 mt -111.46 12.17 21.43 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 116.31 -0.405 . . . . 0.0 111.526 -177.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 60.9 mmtt -58.04 141.4 50.05 Favored 'General case' 0 CA--C 1.498 -1.026 0 CA-C-O 121.96 0.886 . . . . 0.0 109.562 -179.613 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 70.7 t -65.42 -36.29 77.33 Favored 'Isoleucine or valine' 0 C--N 1.312 -1.052 0 CA-C-N 113.86 -1.518 . . . . 0.0 107.808 174.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -74.92 -29.47 60.97 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 113.127 -1.851 . . . . 0.0 112.238 -173.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 10.2 t -165.98 79.54 1.14 Allowed Pre-proline 0 C--N 1.325 -0.457 0 CA-C-N 115.655 -0.702 . . . . 0.0 112.589 -175.228 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 80.8 Cg_endo -73.07 142.5 34.52 Favored 'Trans proline' 0 CA--C 1.532 0.423 0 C-N-CA 115.082 -2.812 . . . . 0.0 112.163 176.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 62.4 t0 -137.13 100.34 4.24 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-O 121.451 0.643 . . . . 0.0 110.383 178.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.4 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.8 OUTLIER -55.5 -46.01 78.71 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.816 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -178.894 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.47 -32.61 68.91 Favored 'General case' 0 CA--C 1.496 -1.107 0 CA-C-O 121.974 0.892 . . . . 0.0 109.933 -176.798 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 68.3 ttt180 -70.41 -40.55 73.8 Favored 'General case' 0 C--N 1.316 -0.854 0 CA-C-N 114.269 -1.332 . . . . 0.0 108.633 -176.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.415 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.59 -50.31 65.57 Favored 'General case' 0 C--O 1.214 -0.797 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 175.305 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.7 mt -56.82 -42.83 80.3 Favored 'General case' 0 N--CA 1.473 0.678 0 N-CA-C 112.105 0.409 . . . . 0.0 112.105 -176.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.1 t-20 -65.52 -37.89 88.08 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-O 121.585 0.707 . . . . 0.0 111.655 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.401 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.77 -46.88 64.83 Favored 'General case' 0 C--N 1.321 -0.635 0 CA-C-O 121.622 0.725 . . . . 0.0 109.694 178.172 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.415 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.92 -49.34 71.53 Favored 'General case' 0 N--CA 1.428 -1.541 0 CA-C-N 115.065 -0.97 . . . . 0.0 110.873 177.677 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -59.32 -36.58 75.91 Favored 'General case' 0 C--N 1.326 -0.456 0 N-CA-C 113.209 0.818 . . . . 0.0 113.209 -176.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -72.8 -44.59 61.32 Favored 'General case' 0 C--N 1.331 -0.234 0 N-CA-C 108.361 -0.977 . . . . 0.0 108.361 178.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -59.4 -34.79 72.89 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-O 121.059 0.457 . . . . 0.0 110.459 -178.36 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.46 -16.48 65.27 Favored Glycine 0 C--O 1.24 0.491 0 N-CA-C 115.359 0.904 . . . . 0.0 115.359 -179.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.4 t -113.01 -12.19 13.26 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 117.413 0.607 . . . . 0.0 110.633 -179.452 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -67.64 149.19 50.38 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 179.427 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.428 ' O ' HD13 ' A' ' 512' ' ' ILE . 37.1 tt0 -77.28 84.51 3.73 Favored 'General case' 0 C--O 1.216 -0.691 0 CA-C-O 122.537 1.16 . . . . 0.0 108.979 177.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.87 HG21 HD22 ' A' ' 546' ' ' LEU . 26.9 m -98.73 47.59 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.374 0 CA-C-O 122.96 1.362 . . . . 0.0 108.194 -178.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.0 t -66.21 173.43 3.16 Favored 'General case' 0 C--N 1.314 -0.948 0 N-CA-C 107.212 -1.403 . . . . 0.0 107.212 -179.246 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.8 m -49.33 -33.65 13.87 Favored 'General case' 0 C--O 1.211 -0.949 0 N-CA-C 113.462 0.912 . . . . 0.0 113.462 -174.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -55.35 -45.44 76.47 Favored 'General case' 0 C--N 1.323 -0.548 0 O-C-N 122.202 -0.311 . . . . 0.0 111.771 177.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.428 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.1 mp -83.76 -42.52 17.4 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.659 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 179.597 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.424 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.92 -37.32 79.11 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 113.039 0.755 . . . . 0.0 113.039 -175.746 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -66.78 -32.89 74.47 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 120.477 0.18 . . . . 0.0 111.401 -179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -88.87 -6.44 57.32 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 120.861 -0.336 . . . . 0.0 110.843 179.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 52.4 m-80 -129.89 44.35 2.98 Favored 'General case' 0 C--N 1.327 -0.388 0 N-CA-C 113.098 0.777 . . . . 0.0 113.098 -178.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 32.3 p -64.88 -24.76 67.63 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 112.492 0.553 . . . . 0.0 112.492 -179.844 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -64.84 -33.26 75.59 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-O 122.399 1.095 . . . . 0.0 112.317 178.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.488 HG21 HD21 ' A' ' 475' ' ' LEU . 91.5 t -67.69 -43.18 86.83 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.849 0 N-CA-C 107.477 -1.305 . . . . 0.0 107.477 179.517 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . 0.412 HG21 HD13 ' A' ' 513' ' ' LEU . 40.4 t -64.28 -37.45 79.97 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.594 0 N-CA-C 108.41 -0.959 . . . . 0.0 108.41 178.488 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.91 -34.5 78.1 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.642 177.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 87.4 m -76.59 -39.64 51.98 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 109.644 -0.502 . . . . 0.0 109.644 -179.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.58 HD23 HD11 ' A' ' 526' ' ' ILE . 51.9 mt -58.62 -34.79 71.55 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.1 0.476 . . . . 0.0 110.926 179.025 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.6 mtmt -64.65 -29.18 70.18 Favored 'General case' 0 CA--C 1.539 0.529 0 O-C-N 121.912 -0.493 . . . . 0.0 111.32 175.086 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.1 mttm -73.05 -44.75 60.27 Favored 'General case' 0 N--CA 1.474 0.734 0 O-C-N 122.283 -0.261 . . . . 0.0 111.654 178.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.58 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.43 -20.57 13.27 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.905 0 N-CA-C 114.896 1.443 . . . . 0.0 114.896 -176.362 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.412 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.4 OUTLIER -62.19 -17.41 58.04 Favored 'General case' 0 C--O 1.212 -0.916 0 N-CA-C 111.97 0.359 . . . . 0.0 111.97 177.165 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 16.3 ptm180 -118.72 19.31 13.21 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.174 0.59 . . . . 0.0 112.128 176.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.434 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 13.2 t80 -63.8 117.68 7.26 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.06 0.457 . . . . 0.0 112.211 -177.482 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -75.97 -31.47 59.03 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 115.701 1.741 . . . . 0.0 115.701 -177.217 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.434 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -64.11 -41.73 97.14 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 112.731 0.641 . . . . 0.0 112.731 -173.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.1 m120 -133.21 118.27 18.42 Favored 'General case' 0 C--N 1.324 -0.533 0 N-CA-C 110.25 -0.278 . . . . 0.0 110.25 -178.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.1 tptt -58.8 -45.7 89.27 Favored 'General case' 0 C--O 1.208 -1.092 0 CA-C-N 116.52 -0.309 . . . . 0.0 110.362 178.638 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -56.07 -41.75 75.59 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 112.291 0.478 . . . . 0.0 112.291 -176.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 68.6 t -56.57 -44.94 81.99 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.658 0 O-C-N 121.87 -0.519 . . . . 0.0 109.813 176.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.7 ttp -64.07 -43.89 94.08 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-O 119.167 -0.444 . . . . 0.0 109.846 179.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.89 -47.39 77.98 Favored 'General case' 0 C--N 1.323 -0.554 0 C-N-CA 120.326 -0.55 . . . . 0.0 112.085 -179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.3 tptt -70.11 -37.96 75.5 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 119.089 -1.045 . . . . 0.0 111.253 -179.083 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.54 -40.65 87.93 Favored 'General case' 0 C--O 1.215 -0.755 0 N-CA-C 108.567 -0.901 . . . . 0.0 108.567 178.153 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.412 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.41 -49.23 72.35 Favored 'General case' 0 C--N 1.313 -0.994 0 CA-C-N 114.536 -1.211 . . . . 0.0 112.543 179.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.36 -43.23 88.3 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 109.001 -0.74 . . . . 0.0 109.001 -179.825 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 55.2 t -70.32 -49.98 49.87 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.041 0 C-N-CA 122.924 0.49 . . . . 0.0 111.318 -177.758 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 55.4 t80 -55.44 -45.82 76.81 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 109.916 -0.402 . . . . 0.0 109.916 -178.144 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 17.6 m -66.18 -35.18 79.78 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.515 0.674 . . . . 0.0 111.029 179.445 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 13.1 mtt85 -60.82 -30.32 70.01 Favored 'General case' 0 C--N 1.324 -0.518 0 O-C-N 121.993 -0.442 . . . . 0.0 109.952 174.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.87 HD22 HG21 ' A' ' 508' ' ' VAL . 8.3 mt -76.55 -34.48 58.5 Favored 'General case' 0 C--O 1.208 -1.119 0 N-CA-C 107.954 -1.128 . . . . 0.0 107.954 -176.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.67 -28.19 69.22 Favored 'General case' 0 C--O 1.216 -0.707 0 CA-C-N 115.315 -0.857 . . . . 0.0 111.587 179.423 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 25.2 m -78.24 -8.58 58.52 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.67 -1.15 . . . . 0.0 111.946 177.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 84.6 mtt85 -117.23 -21.68 8.66 Favored 'General case' 0 N--CA 1.474 0.773 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -179.446 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -169.31 163.53 37.17 Favored Glycine 0 CA--C 1.519 0.303 0 N-CA-C 110.289 -1.124 . . . . 0.0 110.289 -179.362 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 10.9 m . . . . . 0 C--O 1.248 1.015 0 N-CA-C 114.179 1.177 . . . . 0.0 114.179 -176.301 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.786 0 CA-C-O 118.531 -0.747 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 55.38 36.89 28.04 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.912 0.758 . . . . 0.0 111.249 -178.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 15.0 m -133.45 79.17 61.03 Favored Pre-proline 0 C--N 1.326 -0.447 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.207 -178.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -69.32 161.69 44.85 Favored 'Trans proline' 0 C--O 1.237 0.469 0 O-C-N 122.089 0.521 . . . . 0.0 112.721 179.436 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 7.3 m -64.57 160.46 19.53 Favored 'General case' 0 C--N 1.326 -0.444 0 CA-C-N 116.013 -0.539 . . . . 0.0 112.399 -177.605 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.496 HG23 ' HB3' ' A' ' 506' ' ' LEU . 0.1 OUTLIER -53.06 -54.21 18.23 Favored 'Isoleucine or valine' 0 C--O 1.207 -1.137 0 CA-C-O 121.967 0.889 . . . . 0.0 112.134 -179.627 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.6 pt-20 -54.24 -34.24 60.24 Favored 'General case' 0 C--N 1.303 -1.417 0 CA-C-N 113.744 -1.571 . . . . 0.0 113.423 178.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -69.85 -43.8 71.18 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 122.531 1.157 . . . . 0.0 108.167 178.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -70.06 -32.77 71.03 Favored 'General case' 0 C--N 1.321 -0.64 0 CA-C-N 114.918 -1.037 . . . . 0.0 110.564 -177.245 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.722 HD21 HG21 ' A' ' 519' ' ' VAL . 2.5 tt -56.99 -35.66 69.48 Favored 'General case' 0 C--N 1.318 -0.769 0 CA-C-N 115.314 -0.857 . . . . 0.0 109.447 178.191 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 92.8 mt-30 -58.5 -40.75 83.69 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 118.523 0.601 . . . . 0.0 109.92 178.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 77.0 tttt -66.85 -54.89 17.86 Favored 'General case' 0 C--O 1.221 -0.431 0 N-CA-C 110.334 -0.247 . . . . 0.0 110.334 178.069 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -58.9 -43.31 90.98 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -178.569 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.481 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.5 t-160 -57.31 -44.05 83.78 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 179.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.9 m -63.95 -38.5 91.31 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 111.485 0.18 . . . . 0.0 111.485 -179.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 12.3 mm-40 -63.3 -38.65 91.98 Favored 'General case' 0 CA--C 1.506 -0.746 0 C-N-CA 120.794 -0.362 . . . . 0.0 110.28 178.393 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.9 mt -58.22 -43.95 86.86 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.097 0 N-CA-C 107.5 -1.296 . . . . 0.0 107.5 179.172 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -62.85 -44.74 95.32 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -178.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -66.36 -31.8 72.8 Favored 'General case' 0 C--N 1.323 -0.567 0 CA-C-N 116.454 -0.339 . . . . 0.0 111.023 -178.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.2 -18.39 65.23 Favored 'General case' 0 C--N 1.32 -0.707 0 N-CA-C 112.897 0.702 . . . . 0.0 112.897 179.491 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . 0.41 HD11 ' CG2' ' A' ' 526' ' ' ILE . 20.9 mt -106.84 12.14 29.29 Favored 'General case' 0 C--N 1.325 -0.479 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -177.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 56.7 mttt -54.72 130.15 39.52 Favored 'General case' 0 C--O 1.208 -1.119 0 N-CA-C 107.649 -1.241 . . . . 0.0 107.649 178.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 55.8 t -63.5 -42.2 95.36 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 CA-C-O 122.056 0.931 . . . . 0.0 109.471 178.861 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 32.6 t70 -67.6 -30.86 70.56 Favored 'General case' 0 C--N 1.319 -0.754 0 CA-C-N 113.979 -1.464 . . . . 0.0 112.975 -178.272 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 13.8 t -160.08 77.55 2.73 Favored Pre-proline 0 C--N 1.325 -0.494 0 CA-C-N 116.237 -0.438 . . . . 0.0 112.002 -175.416 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 93.2 Cg_endo -75.61 149.23 34.01 Favored 'Trans proline' 0 C--N 1.343 0.282 0 C-N-CA 117.123 -1.451 . . . . 0.0 112.383 179.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 63.9 t0 -137.21 97.77 3.57 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-O 121.857 0.836 . . . . 0.0 110.078 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.44 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.7 OUTLIER -58.22 -46.36 88.72 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.769 0 N-CA-C 112.86 0.689 . . . . 0.0 112.86 -179.212 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -59.74 -31.38 69.58 Favored 'General case' 0 CA--C 1.504 -0.811 0 N-CA-C 109.53 -0.544 . . . . 0.0 109.53 -177.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.8 ttt180 -69.08 -41.6 77.32 Favored 'General case' 0 C--N 1.322 -0.615 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 -177.78 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -64.53 -47.89 77.12 Favored 'General case' 0 C--O 1.21 -1.021 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 175.912 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 84.6 mt -57.68 -44.06 85.52 Favored 'General case' 0 N--CA 1.474 0.729 0 CA-C-N 118.045 0.384 . . . . 0.0 111.346 -176.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -63.07 -40.88 99.0 Favored 'General case' 0 C--N 1.326 -0.456 0 CA-C-O 121.735 0.779 . . . . 0.0 110.901 178.683 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.14 -46.65 73.44 Favored 'General case' 0 C--N 1.322 -0.617 0 CA-C-O 121.762 0.791 . . . . 0.0 109.529 -179.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.401 HD23 ' HB3' ' A' ' 538' ' ' LYS . 0.0 OUTLIER -56.11 -51.16 68.91 Favored 'General case' 0 N--CA 1.429 -1.518 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.337 178.339 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -61.44 -35.66 78.19 Favored 'General case' 0 C--N 1.322 -0.589 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -175.142 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -72.26 -43.25 64.6 Favored 'General case' 0 C--O 1.223 -0.318 0 C-N-CA 118.775 -1.17 . . . . 0.0 108.473 177.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -33.31 67.6 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-O 121.359 0.599 . . . . 0.0 109.895 178.385 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.62 -17.68 69.21 Favored Glycine 0 C--O 1.238 0.379 0 N-CA-C 114.833 0.693 . . . . 0.0 114.833 179.502 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.3 t -110.5 -14.83 14.03 Favored 'General case' 0 CA--C 1.535 0.395 0 CA-C-N 117.714 0.757 . . . . 0.0 110.402 179.382 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.496 ' HB3' HG23 ' A' ' 471' ' ' VAL . 2.4 mt -66.51 149.28 50.68 Favored 'General case' 0 C--N 1.328 -0.353 0 O-C-N 122.008 -0.433 . . . . 0.0 110.211 179.233 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.415 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.1 tt0 -78.76 84.4 4.83 Favored 'General case' 0 C--O 1.213 -0.861 0 CA-C-O 122.324 1.059 . . . . 0.0 111.916 -178.783 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.504 HG21 HD22 ' A' ' 546' ' ' LEU . 17.5 m -106.93 76.9 0.44 Allowed 'Isoleucine or valine' 0 C--N 1.307 -1.241 0 CA-C-O 126.897 3.237 . . . . 0.0 106.514 176.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.3 t -88.46 171.59 9.99 Favored 'General case' 0 C--N 1.292 -1.905 0 CA-C-N 110.235 -3.166 . . . . 0.0 103.677 172.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.26 -34.61 15.6 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 113.802 1.038 . . . . 0.0 113.802 -175.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 62.1 tt0 -55.49 -41.51 73.13 Favored 'General case' 0 C--N 1.325 -0.486 0 N-CA-C 113.429 0.9 . . . . 0.0 113.429 179.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.415 HD13 ' O ' ' A' ' 507' ' ' GLN . 3.8 mp -88.74 -39.65 12.72 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.822 0 CA-C-O 122.483 1.135 . . . . 0.0 108.912 -178.644 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 31.1 mt -60.78 -39.65 89.65 Favored 'General case' 0 N--CA 1.434 -1.247 0 CA-C-N 114.894 -1.048 . . . . 0.0 112.139 -174.214 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 22.0 pt20 -63.44 -34.82 78.6 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 179.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -89.95 -8.06 52.62 Favored 'General case' 0 C--N 1.322 -0.589 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.24 -179.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -125.92 37.83 4.27 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.428 0.632 . . . . 0.0 110.711 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 3.6 p -61.1 -28.11 68.85 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 113.557 0.947 . . . . 0.0 113.557 -178.084 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -63.57 -30.46 71.57 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-O 121.426 0.631 . . . . 0.0 112.136 178.408 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.722 HG21 HD21 ' A' ' 475' ' ' LEU . 34.0 t -74.24 -42.94 50.98 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.654 0 N-CA-C 107.754 -1.202 . . . . 0.0 107.754 179.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 39.7 t -61.94 -37.75 79.02 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.543 0 N-CA-C 107.897 -1.149 . . . . 0.0 107.897 178.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.86 -37.76 88.7 Favored 'General case' 0 C--N 1.324 -0.519 0 CA-C-N 116.192 -0.458 . . . . 0.0 110.734 177.154 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 95.6 m -71.23 -39.31 71.76 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 109.957 -0.386 . . . . 0.0 109.957 -179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.679 HD23 HD11 ' A' ' 526' ' ' ILE . 70.0 mt -59.67 -35.75 75.08 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-O 121.199 0.523 . . . . 0.0 110.362 -179.945 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -65.2 -29.09 69.87 Favored 'General case' 0 CA--C 1.537 0.477 0 O-C-N 121.947 -0.471 . . . . 0.0 111.254 175.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -72.18 -45.62 59.65 Favored 'General case' 0 N--CA 1.475 0.785 0 O-C-N 122.098 -0.376 . . . . 0.0 111.349 178.463 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.679 HD11 HD23 ' A' ' 523' ' ' LEU . 17.1 pt -78.79 -18.1 13.3 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.864 0 N-CA-C 115.233 1.568 . . . . 0.0 115.233 -176.672 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.468 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.79 -15.93 59.94 Favored 'General case' 0 C--O 1.212 -0.899 0 O-C-N 121.965 -0.459 . . . . 0.0 111.503 176.287 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 9.2 ptm180 -118.72 17.94 13.47 Favored 'General case' 0 N--CA 1.469 0.52 0 C-N-CA 122.774 0.429 . . . . 0.0 111.241 176.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.41 ' CE2' ' HB3' ' A' ' 531' ' ' ALA . 14.7 t80 -63.02 123.65 19.11 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 122.667 0.387 . . . . 0.0 110.207 -178.346 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -92.4 -21.92 19.94 Favored 'General case' 0 C--O 1.218 -0.561 0 N-CA-C 115.541 1.682 . . . . 0.0 115.541 -175.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.41 ' HB3' ' CE2' ' A' ' 529' ' ' TYR . . . -65.89 -41.61 91.31 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 121.265 0.555 . . . . 0.0 110.589 -177.58 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 32.8 m120 -130.26 115.55 17.13 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-N 116.128 -0.487 . . . . 0.0 110.025 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.6 tptt -55.76 -47.95 76.13 Favored 'General case' 0 C--O 1.207 -1.142 0 CA-C-N 116.197 -0.456 . . . . 0.0 110.222 177.785 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -54.99 -42.81 72.95 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 -175.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.7 t -56.68 -45.08 82.57 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.573 0 O-C-N 122.016 -0.428 . . . . 0.0 109.887 177.164 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.4 ttp -65.04 -43.79 91.19 Favored 'General case' 0 CA--C 1.51 -0.59 0 N-CA-C 110.001 -0.37 . . . . 0.0 110.001 -179.817 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.4 mm-40 -63.56 -48.6 76.78 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 112.252 0.464 . . . . 0.0 112.252 179.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . 0.401 ' HB3' HD23 ' A' ' 500' ' ' LEU . 44.0 tptt -71.0 -38.36 72.66 Favored 'General case' 0 C--O 1.221 -0.435 0 C-N-CA 119.24 -0.984 . . . . 0.0 111.282 -178.085 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.52 -39.96 85.58 Favored 'General case' 0 CA--C 1.501 -0.926 0 CA-C-O 121.625 0.726 . . . . 0.0 109.044 178.709 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.468 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.89 -49.04 76.4 Favored 'General case' 0 C--N 1.309 -1.18 0 CA-C-N 114.535 -1.211 . . . . 0.0 113.052 178.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.81 -41.35 91.08 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 179.154 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 51.2 t -70.45 -51.99 33.13 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.021 0 CA-C-N 116.037 -0.529 . . . . 0.0 111.676 -177.562 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 56.6 t80 -54.59 -45.05 73.51 Favored 'General case' 0 C--N 1.319 -0.737 0 CA-C-O 120.633 0.254 . . . . 0.0 110.317 -178.121 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 20.5 m -65.93 -36.03 82.24 Favored 'General case' 0 C--N 1.324 -0.54 0 CA-C-O 120.886 0.374 . . . . 0.0 111.248 179.438 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 7.3 mtt85 -59.37 -30.74 68.62 Favored 'General case' 0 C--N 1.324 -0.523 0 O-C-N 122.038 -0.413 . . . . 0.0 110.26 176.109 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.504 HD22 HG21 ' A' ' 508' ' ' VAL . 6.3 mt -76.63 -32.81 58.26 Favored 'General case' 0 C--O 1.212 -0.904 0 N-CA-C 108.194 -1.039 . . . . 0.0 108.194 -176.628 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.71 -30.22 71.35 Favored 'General case' 0 C--O 1.217 -0.633 0 CA-C-N 115.24 -0.891 . . . . 0.0 111.67 179.46 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 36.2 m -75.13 -16.47 60.53 Favored 'General case' 0 C--N 1.316 -0.878 0 CA-C-N 115.813 -0.63 . . . . 0.0 111.706 176.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 84.3 mtt85 -100.79 -23.72 14.54 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 178.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -177.56 173.64 46.29 Favored Glycine 0 N--CA 1.452 -0.234 0 C-N-CA 121.251 -0.499 . . . . 0.0 112.773 -178.012 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 4.7 m . . . . . 0 C--O 1.251 1.135 0 N-CA-C 113.807 1.04 . . . . 0.0 113.807 -176.933 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.687 0 CA-C-O 118.95 -0.547 . . . . 0.0 109.574 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -133.78 33.67 3.45 Favored 'General case' 0 C--O 1.222 -0.372 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 -179.887 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 14.8 m -76.75 139.94 67.04 Favored Pre-proline 0 C--N 1.323 -0.553 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 179.91 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -68.84 150.63 73.82 Favored 'Trans proline' 0 C--O 1.24 0.62 0 C-N-CA 117.289 -1.34 . . . . 0.0 113.129 179.792 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 12.3 m -69.25 163.2 25.54 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.453 -0.794 . . . . 0.0 111.798 -178.874 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.435 HG13 ' HB3' ' A' ' 506' ' ' LEU . 44.0 t -54.8 -46.9 75.04 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.009 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 179.478 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.412 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.9 OUTLIER -62.24 -34.35 76.34 Favored 'General case' 0 C--N 1.317 -0.812 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -178.454 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -67.91 -41.2 83.02 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-O 122.579 1.181 . . . . 0.0 108.184 179.698 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . 0.405 ' O ' HD22 ' A' ' 478' ' ' LEU . 58.2 mtpt -72.9 -35.31 67.06 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-N 114.93 -1.032 . . . . 0.0 109.569 -177.876 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.5 HD21 HG21 ' A' ' 519' ' ' VAL . 3.8 tt -57.92 -36.66 72.8 Favored 'General case' 0 C--O 1.211 -0.933 0 CA-C-N 115.179 -0.919 . . . . 0.0 109.361 178.464 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -57.32 -42.42 81.82 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 118.835 0.743 . . . . 0.0 110.124 177.909 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -67.44 -54.33 21.23 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.913 -0.315 . . . . 0.0 110.645 178.118 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . 0.405 HD22 ' O ' ' A' ' 474' ' ' LYS . 0.1 OUTLIER -58.27 -44.85 88.62 Favored 'General case' 0 C--O 1.218 -0.569 0 N-CA-C 112.373 0.508 . . . . 0.0 112.373 -178.465 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.426 ' CG ' HG22 ' A' ' 519' ' ' VAL . 15.6 t-160 -57.79 -44.5 86.31 Favored 'General case' 0 C--N 1.321 -0.647 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 -179.89 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.2 m -62.84 -39.3 93.94 Favored 'General case' 0 C--N 1.329 -0.324 0 N-CA-C 111.623 0.231 . . . . 0.0 111.623 -179.03 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.456 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 14.6 mm-40 -63.98 -37.53 87.77 Favored 'General case' 0 CA--C 1.507 -0.705 0 C-N-CA 120.539 -0.464 . . . . 0.0 110.396 178.507 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.4 mt -58.99 -43.53 89.08 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.094 0 N-CA-C 106.991 -1.485 . . . . 0.0 106.991 178.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 16.2 mmtt -64.01 -44.06 93.76 Favored 'General case' 0 N--CA 1.478 0.937 0 O-C-N 122.082 -0.386 . . . . 0.0 112.003 -178.875 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.1 m-85 -65.83 -32.8 74.52 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.621 -0.263 . . . . 0.0 110.75 -178.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.89 -16.67 64.19 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.516 0.561 . . . . 0.0 112.516 179.224 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 35.2 mt -110.51 12.21 22.91 Favored 'General case' 0 C--N 1.325 -0.469 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -177.224 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 50.0 mttt -55.26 132.65 48.32 Favored 'General case' 0 C--O 1.211 -0.957 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 177.255 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.9 t -64.17 -41.71 93.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 CA-C-O 122.343 1.068 . . . . 0.0 108.484 176.808 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -68.14 -29.75 68.71 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 113.574 -1.648 . . . . 0.0 113.281 -178.417 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 10.8 t -160.69 75.99 2.65 Favored Pre-proline 0 N--CA 1.469 0.513 0 N-CA-C 113.145 0.794 . . . . 0.0 113.145 -175.662 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_endo -75.36 145.87 30.75 Favored 'Trans proline' 0 CA--C 1.535 0.527 0 C-N-CA 117.203 -1.398 . . . . 0.0 113.206 178.915 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.7 t0 -137.32 100.66 4.3 Favored 'General case' 0 N--CA 1.47 0.53 0 CA-C-O 121.286 0.565 . . . . 0.0 111.092 178.826 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.441 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.5 OUTLIER -56.66 -45.36 82.58 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -179.341 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 10.9 pttt -59.33 -32.53 70.17 Favored 'General case' 0 CA--C 1.499 -0.995 0 CA-C-O 121.89 0.852 . . . . 0.0 109.605 -176.919 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.5 ttt180 -70.39 -40.8 73.73 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.417 -1.265 . . . . 0.0 108.816 -176.473 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -65.81 -48.5 71.5 Favored 'General case' 0 C--O 1.215 -0.751 0 N-CA-C 108.615 -0.883 . . . . 0.0 108.615 175.887 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 82.8 mt -56.93 -43.39 81.44 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 111.955 0.354 . . . . 0.0 111.955 -176.724 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -65.42 -37.9 88.31 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-O 121.488 0.661 . . . . 0.0 111.745 179.608 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.456 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.33 -46.67 66.51 Favored 'General case' 0 C--N 1.321 -0.636 0 CA-C-O 121.721 0.772 . . . . 0.0 109.682 178.363 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -55.53 -49.39 72.75 Favored 'General case' 0 N--CA 1.427 -1.579 0 CA-C-N 114.732 -1.122 . . . . 0.0 110.396 178.938 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -61.46 -34.66 75.83 Favored 'General case' 0 C--N 1.322 -0.628 0 N-CA-C 113.997 1.11 . . . . 0.0 113.997 -175.238 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.86 -45.71 60.42 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 108.063 -1.088 . . . . 0.0 108.063 176.731 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -57.93 -33.51 68.87 Favored 'General case' 0 CA--C 1.537 0.443 0 CA-C-O 121.465 0.65 . . . . 0.0 109.868 -178.691 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.93 -17.87 68.05 Favored Glycine 0 C--O 1.236 0.251 0 CA-C-O 119.206 -0.775 . . . . 0.0 114.852 179.423 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.7 t -112.53 -6.23 13.97 Favored 'General case' 0 C--N 1.326 -0.415 0 CA-C-N 118.345 1.073 . . . . 0.0 110.894 -179.733 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.435 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.0 mt -72.49 150.16 43.5 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 109.442 -0.577 . . . . 0.0 109.442 179.05 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -78.84 84.46 4.89 Favored 'General case' 0 C--O 1.218 -0.593 0 CA-C-O 122.671 1.224 . . . . 0.0 109.213 178.145 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.897 HG21 HD22 ' A' ' 546' ' ' LEU . 27.1 m -98.63 50.72 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.305 0 CA-C-O 123.536 1.636 . . . . 0.0 109.115 -177.379 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 3.7 t -64.51 167.83 6.62 Favored 'General case' 0 C--N 1.315 -0.911 0 N-CA-C 106.139 -1.8 . . . . 0.0 106.139 -179.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 42.7 m -49.25 -32.16 10.16 Favored 'General case' 0 C--O 1.215 -0.732 0 N-CA-C 112.941 0.719 . . . . 0.0 112.941 -176.185 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 63.1 tt0 -55.38 -44.7 76.31 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 111.924 0.342 . . . . 0.0 111.924 178.28 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.0 mp -85.97 -43.46 16.46 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.586 0 CA-C-O 121.961 0.886 . . . . 0.0 108.887 179.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.57 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.13 -39.91 79.91 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 113.932 1.086 . . . . 0.0 113.932 -175.182 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 85.0 mt-30 -72.7 -28.51 62.72 Favored 'General case' 0 C--N 1.32 -0.696 0 CA-C-N 116.338 -0.392 . . . . 0.0 111.346 -176.767 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -88.99 -8.25 54.45 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 120.898 -0.321 . . . . 0.0 110.862 176.709 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -125.1 40.97 3.62 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-O 121.631 0.729 . . . . 0.0 111.735 -179.066 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 10.7 p -62.75 -24.48 67.72 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 113.404 0.89 . . . . 0.0 113.404 -179.103 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -63.62 -30.86 71.92 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.45 0.643 . . . . 0.0 112.037 177.954 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.5 HG21 HD21 ' A' ' 475' ' ' LEU . 22.6 t -71.87 -41.34 69.44 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.606 0 N-CA-C 107.578 -1.267 . . . . 0.0 107.578 178.89 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . 0.418 HG21 HD13 ' A' ' 513' ' ' LEU . 29.9 t -63.22 -37.98 80.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.515 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 178.681 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.93 -32.59 74.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-N 116.083 -0.508 . . . . 0.0 110.653 177.737 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.4 m -79.49 -40.22 30.24 Favored 'General case' 0 C--O 1.217 -0.632 0 N-CA-C 109.523 -0.547 . . . . 0.0 109.523 179.922 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.512 HD23 HD11 ' A' ' 526' ' ' ILE . 38.7 mt -57.61 -35.41 70.42 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-O 121.114 0.483 . . . . 0.0 111.039 178.57 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 55.4 mtmt -63.97 -29.05 70.24 Favored 'General case' 0 C--N 1.324 -0.512 0 O-C-N 122.07 -0.394 . . . . 0.0 111.533 175.175 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.2 mttm -74.13 -45.42 48.98 Favored 'General case' 0 N--CA 1.473 0.681 0 O-C-N 122.272 -0.268 . . . . 0.0 111.547 178.655 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.512 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -77.53 -21.23 14.04 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.932 0 N-CA-C 114.903 1.446 . . . . 0.0 114.903 -176.427 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.421 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -61.56 -18.87 61.12 Favored 'General case' 0 C--O 1.211 -0.959 0 O-C-N 121.961 -0.462 . . . . 0.0 111.658 176.056 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -118.75 19.44 13.15 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.154 0.582 . . . . 0.0 111.965 177.15 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.435 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 10.1 t80 -59.97 123.32 16.72 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 121.136 0.493 . . . . 0.0 111.629 -177.805 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 62.5 mttm -81.79 -28.46 33.18 Favored 'General case' 0 C--O 1.217 -0.612 0 N-CA-C 115.338 1.607 . . . . 0.0 115.338 -176.744 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.435 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -69.17 -38.81 78.9 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 -174.721 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.0 m120 -135.05 121.38 20.31 Favored 'General case' 0 C--N 1.324 -0.508 0 CA-C-O 120.768 0.318 . . . . 0.0 110.765 -177.937 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 42.7 tptt -64.17 -40.32 95.87 Favored 'General case' 0 C--O 1.211 -0.958 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 178.221 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -54.59 -46.97 73.88 Favored 'General case' 0 C--N 1.318 -0.78 0 C-N-CA 123.341 0.656 . . . . 0.0 111.467 -176.525 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.0 t -58.73 -44.75 90.74 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.617 0 CA-C-N 115.473 -0.785 . . . . 0.0 109.904 178.331 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -62.11 -44.2 97.16 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 109.872 -0.418 . . . . 0.0 109.872 -179.688 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.97 -47.45 77.53 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 120.419 -0.512 . . . . 0.0 112.229 179.814 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 38.1 tptt -70.18 -38.21 75.34 Favored 'General case' 0 C--O 1.22 -0.49 0 C-N-CA 118.408 -1.317 . . . . 0.0 111.285 -178.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.4 -39.73 84.34 Favored 'General case' 0 C--O 1.213 -0.832 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 178.365 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.421 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.91 -48.93 72.4 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-N 114.813 -1.085 . . . . 0.0 113.036 178.756 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.33 -41.62 89.55 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 108.938 -0.764 . . . . 0.0 108.938 179.84 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.9 t -70.52 -50.33 46.08 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.013 0 CA-C-N 116.155 -0.475 . . . . 0.0 110.937 -178.276 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 60.4 t80 -55.49 -44.74 76.81 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 110.004 -0.369 . . . . 0.0 110.004 -178.211 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.1 m -66.63 -35.57 80.49 Favored 'General case' 0 C--N 1.324 -0.522 0 CA-C-O 121.263 0.554 . . . . 0.0 111.131 179.184 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 15.5 mtt85 -61.2 -29.43 69.81 Favored 'General case' 0 C--N 1.325 -0.484 0 O-C-N 121.879 -0.513 . . . . 0.0 109.99 175.217 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.897 HD22 HG21 ' A' ' 508' ' ' VAL . 8.8 mt -76.6 -36.03 57.76 Favored 'General case' 0 C--O 1.205 -1.268 0 N-CA-C 108.006 -1.109 . . . . 0.0 108.006 -177.555 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.23 -30.1 70.24 Favored 'General case' 0 C--O 1.215 -0.727 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.588 178.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.4 m -75.7 -8.55 57.11 Favored 'General case' 0 C--N 1.318 -0.801 0 CA-C-N 115.004 -0.998 . . . . 0.0 112.108 178.483 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 67.3 mtt85 -118.28 -23.28 7.34 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 113.111 0.782 . . . . 0.0 113.111 -179.945 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . 172.83 147.82 6.01 Favored Glycine 0 N--CA 1.452 -0.246 0 N-CA-C 115.183 0.833 . . . . 0.0 115.183 178.974 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . 0.432 ' HB2' HD12 ' A' ' 513' ' ' LEU . 3.7 m . . . . . 0 C--O 1.254 1.326 0 N-CA-C 115.64 1.719 . . . . 0.0 115.64 177.476 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.596 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -70.7 164.48 24.96 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 176.79 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 67.0 m -145.44 152.24 49.27 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 107.037 -1.468 . . . . 0.0 107.037 178.048 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 62.3 Cg_endo -67.57 151.49 79.49 Favored 'Trans proline' 0 C--O 1.244 0.781 0 C-N-CA 118.204 -0.73 . . . . 0.0 113.787 -179.04 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.4 m -69.8 168.82 14.29 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-N 115.368 -0.833 . . . . 0.0 111.86 179.963 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.441 HG13 HD23 ' A' ' 506' ' ' LEU . 45.0 t -56.09 -47.93 79.74 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.929 0 N-CA-C 111.988 0.366 . . . . 0.0 111.988 -179.749 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.419 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.4 OUTLIER -64.94 -34.26 78.0 Favored 'General case' 0 C--N 1.315 -0.918 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 -178.57 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -66.49 -43.59 84.98 Favored 'General case' 0 C--N 1.325 -0.494 0 N-CA-C 108.384 -0.969 . . . . 0.0 108.384 177.024 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 19.7 mttt -69.37 -33.75 73.53 Favored 'General case' 0 CA--C 1.507 -0.711 0 CA-C-N 115.326 -0.852 . . . . 0.0 110.368 -178.02 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -56.71 -38.88 72.93 Favored 'General case' 0 C--N 1.318 -0.777 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.607 -178.603 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 71.9 mt-30 -54.98 -40.22 69.84 Favored 'General case' 0 C--N 1.324 -0.508 0 C-N-CA 120.589 -0.444 . . . . 0.0 110.992 -178.862 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 56.6 tttt -67.02 -55.06 16.0 Favored 'General case' 0 N--CA 1.468 0.43 0 N-CA-C 110.214 -0.291 . . . . 0.0 110.214 176.89 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -60.11 -46.14 90.63 Favored 'General case' 0 C--O 1.216 -0.683 0 N-CA-C 114.194 1.183 . . . . 0.0 114.194 -176.712 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.1 t-160 -61.45 -39.5 91.05 Favored 'General case' 0 C--N 1.318 -0.8 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.644 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 65.2 m -65.11 -41.17 95.17 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 120.507 -0.477 . . . . 0.0 110.556 179.164 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -63.13 -42.64 99.56 Favored 'General case' 0 CA--C 1.501 -0.934 0 C-N-CA 120.976 -0.289 . . . . 0.0 111.19 178.388 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -54.65 -46.64 73.16 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.269 0 N-CA-C 107.903 -1.147 . . . . 0.0 107.903 177.683 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 43.6 mtpt -67.81 -38.85 83.81 Favored 'General case' 0 C--N 1.319 -0.722 0 N-CA-C 113.174 0.805 . . . . 0.0 113.174 -177.425 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -67.32 -32.92 74.22 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.895 0.379 . . . . 0.0 110.198 178.099 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.0 -19.68 66.12 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 112.163 0.431 . . . . 0.0 112.163 178.955 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 25.4 mt -105.22 12.16 32.21 Favored 'General case' 0 C--N 1.324 -0.53 0 N-CA-C 112.444 0.535 . . . . 0.0 112.444 -178.386 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 29.4 mtpt -55.66 130.38 42.92 Favored 'General case' 0 C--O 1.209 -1.034 0 N-CA-C 107.575 -1.268 . . . . 0.0 107.575 177.564 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 44.9 t -63.6 -40.51 89.32 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.786 0 CA-C-O 122.395 1.093 . . . . 0.0 108.931 177.992 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -65.59 -30.44 71.17 Favored 'General case' 0 C--N 1.32 -0.703 0 CA-C-N 113.568 -1.651 . . . . 0.0 113.016 -178.24 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 2.7 p -163.08 79.66 1.68 Allowed Pre-proline 0 C--N 1.324 -0.531 0 N-CA-C 112.143 0.423 . . . . 0.0 112.143 -178.343 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -71.04 146.28 51.9 Favored 'Trans proline' 0 CA--C 1.533 0.429 0 C-N-CA 116.938 -1.575 . . . . 0.0 112.265 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.8 t0 -137.22 92.65 2.73 Favored 'General case' 0 C--N 1.324 -0.533 0 CA-C-O 121.513 0.673 . . . . 0.0 109.921 -175.714 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.418 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.9 OUTLIER -58.9 -45.0 92.06 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.798 0 N-CA-C 113.391 0.885 . . . . 0.0 113.391 -177.229 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -57.12 -31.9 65.78 Favored 'General case' 0 CA--C 1.509 -0.611 0 N-CA-C 110.115 -0.328 . . . . 0.0 110.115 -178.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 63.3 ttm-85 -71.03 -41.47 70.81 Favored 'General case' 0 C--N 1.322 -0.622 0 C-N-CA 120.447 -0.501 . . . . 0.0 109.675 -177.87 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.474 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.4 OUTLIER -63.92 -48.61 75.9 Favored 'General case' 0 C--O 1.211 -0.942 0 N-CA-C 108.295 -1.002 . . . . 0.0 108.295 176.7 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 81.2 mt -57.99 -44.19 87.01 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 117.863 0.301 . . . . 0.0 111.619 -176.935 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -62.16 -39.07 91.4 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-O 121.622 0.725 . . . . 0.0 110.735 178.88 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.82 -49.33 62.83 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 121.357 0.598 . . . . 0.0 109.796 178.816 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.474 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.06 -45.43 83.24 Favored 'General case' 0 N--CA 1.432 -1.36 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.52 178.282 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -65.35 -33.31 75.66 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 121.243 -0.91 . . . . 0.0 112.504 -176.848 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 1.9 tt0 -67.8 -49.37 62.71 Favored 'General case' 0 C--O 1.219 -0.546 0 N-CA-C 105.307 -2.108 . . . . 0.0 105.307 175.395 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -52.73 -30.63 33.53 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-O 121.54 0.686 . . . . 0.0 111.119 -177.64 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -62.97 -28.36 71.88 Favored Glycine 0 N--CA 1.446 -0.658 0 N-CA-C 114.894 0.718 . . . . 0.0 114.894 178.163 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 8.0 t -100.86 -26.36 13.78 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 117.745 0.773 . . . . 0.0 110.808 -179.342 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.441 HD23 HG13 ' A' ' 471' ' ' VAL . 3.0 mp -55.46 136.01 50.04 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 114.096 1.147 . . . . 0.0 114.096 176.362 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 5.5 tt0 -78.81 84.37 4.87 Favored 'General case' 0 C--O 1.215 -0.736 0 CA-C-O 122.975 1.369 . . . . 0.0 110.416 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.919 HG21 HD22 ' A' ' 546' ' ' LEU . 27.4 m -95.7 48.5 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.325 0 CA-C-O 122.963 1.363 . . . . 0.0 108.734 -178.988 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 8.9 t -66.92 171.64 5.21 Favored 'General case' 0 C--N 1.316 -0.873 0 N-CA-C 107.103 -1.443 . . . . 0.0 107.103 -178.219 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 19.7 m -49.23 -30.74 7.52 Favored 'General case' 0 C--O 1.217 -0.65 0 N-CA-C 113.788 1.033 . . . . 0.0 113.788 -174.369 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 57.8 tt0 -55.48 -46.55 76.87 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 122.391 -0.193 . . . . 0.0 111.519 177.052 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.3 mp -87.12 -41.05 14.42 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.55 0 CA-C-O 121.511 0.672 . . . . 0.0 109.695 -179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.507 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -59.7 -36.18 76.0 Favored 'General case' 0 N--CA 1.441 -0.888 0 N-CA-C 112.972 0.73 . . . . 0.0 112.972 -174.894 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 21.3 pt20 -65.4 -32.27 73.81 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-O 121.755 0.788 . . . . 0.0 111.722 -178.679 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 13.2 ptmm? -95.76 -0.33 51.49 Favored 'General case' 0 C--N 1.32 -0.694 0 CA-C-N 115.044 -0.98 . . . . 0.0 111.801 -179.229 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 16.0 m120 -133.01 42.59 3.04 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-O 121.568 0.699 . . . . 0.0 111.613 179.175 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 24.2 p -64.14 -27.21 68.93 Favored 'General case' 0 C--N 1.324 -0.529 0 N-CA-C 113.428 0.899 . . . . 0.0 113.428 -179.122 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -65.04 -24.43 67.48 Favored 'General case' 0 N--CA 1.472 0.646 0 CA-C-O 121.654 0.74 . . . . 0.0 111.938 178.224 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 55.4 t -70.55 -43.53 77.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.685 0 N-CA-C 107.021 -1.474 . . . . 0.0 107.021 179.173 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 28.8 t -64.21 -36.17 76.21 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.533 0 N-CA-C 107.856 -1.164 . . . . 0.0 107.856 179.238 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.26 -38.27 88.63 Favored 'General case' 0 C--N 1.324 -0.505 0 CA-C-N 116.134 -0.484 . . . . 0.0 110.813 177.325 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 97.4 m -76.08 -38.6 56.84 Favored 'General case' 0 C--O 1.218 -0.589 0 CA-C-N 118.874 0.761 . . . . 0.0 109.861 -179.551 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.587 HD23 HD11 ' A' ' 526' ' ' ILE . 49.5 mt -58.15 -35.19 71.16 Favored 'General case' 0 C--N 1.32 -0.715 0 CA-C-O 121.02 0.438 . . . . 0.0 111.226 178.639 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 54.4 mtmt -64.46 -29.18 70.23 Favored 'General case' 0 C--N 1.324 -0.508 0 O-C-N 121.993 -0.442 . . . . 0.0 111.465 175.129 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -73.04 -46.31 52.54 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 117.767 0.258 . . . . 0.0 111.423 178.845 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.587 HD11 HD23 ' A' ' 523' ' ' LEU . 1.0 OUTLIER -77.21 -20.52 14.3 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 N-CA-C 114.938 1.458 . . . . 0.0 114.938 -176.106 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.419 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.3 OUTLIER -62.44 -15.82 51.63 Favored 'General case' 0 C--O 1.212 -0.885 0 N-CA-C 112.505 0.557 . . . . 0.0 112.505 177.259 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 11.6 ptp85 -118.69 19.34 13.23 Favored 'General case' 0 N--CA 1.47 0.535 0 C-N-CA 123.031 0.533 . . . . 0.0 111.458 175.891 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 25.0 t80 -64.07 105.69 0.92 Allowed 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.994 0.739 . . . . 0.0 112.994 -175.72 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -70.09 -30.14 67.29 Favored 'General case' 0 C--O 1.218 -0.576 0 N-CA-C 115.476 1.658 . . . . 0.0 115.476 -176.703 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.74 -27.5 66.85 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -174.637 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -147.69 113.74 5.82 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 109.775 -0.454 . . . . 0.0 109.775 179.096 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 41.8 tptt -56.71 -45.46 81.87 Favored 'General case' 0 C--O 1.211 -0.943 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.531 -178.294 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.9 t0 -56.48 -40.68 75.32 Favored 'General case' 0 C--N 1.322 -0.613 0 CA-C-O 120.987 0.422 . . . . 0.0 112.003 -175.836 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -56.84 -45.1 83.15 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.506 0 N-CA-C 109.661 -0.496 . . . . 0.0 109.661 177.384 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -64.84 -43.41 93.14 Favored 'General case' 0 CA--C 1.509 -0.608 0 CA-C-O 119.192 -0.432 . . . . 0.0 110.241 -179.942 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -64.48 -48.17 76.2 Favored 'General case' 0 C--N 1.323 -0.578 0 C-N-CA 120.409 -0.517 . . . . 0.0 112.005 179.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 31.4 tptt -68.62 -39.48 80.78 Favored 'General case' 0 C--N 1.329 -0.326 0 C-N-CA 119.028 -1.069 . . . . 0.0 111.071 -178.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -58.63 -40.82 84.46 Favored 'General case' 0 C--O 1.214 -0.784 0 CA-C-O 121.306 0.574 . . . . 0.0 109.518 177.827 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.419 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.5 -48.27 75.78 Favored 'General case' 0 C--N 1.314 -0.938 0 CA-C-N 115.247 -0.888 . . . . 0.0 113.296 179.433 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.96 -42.24 93.67 Favored 'General case' 0 C--N 1.321 -0.653 0 N-CA-C 109.099 -0.704 . . . . 0.0 109.099 -179.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.1 t -70.65 -50.09 47.09 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.896 0 CA-C-N 115.945 -0.57 . . . . 0.0 111.8 -178.579 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -54.79 -45.46 74.33 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-O 120.733 0.301 . . . . 0.0 110.193 -177.351 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.6 m -66.82 -33.97 76.77 Favored 'General case' 0 C--N 1.322 -0.626 0 CA-C-O 121.397 0.617 . . . . 0.0 111.312 179.916 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 13.1 mtt85 -61.35 -29.81 70.13 Favored 'General case' 0 C--N 1.324 -0.542 0 O-C-N 121.796 -0.565 . . . . 0.0 109.96 174.885 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.919 HD22 HG21 ' A' ' 508' ' ' VAL . 9.0 mt -76.52 -34.01 58.58 Favored 'General case' 0 CA--C 1.495 -1.16 0 N-CA-C 107.783 -1.191 . . . . 0.0 107.783 -175.208 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.29 -27.87 69.63 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 114.891 -1.05 . . . . 0.0 110.961 178.08 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.7 m -81.44 -8.66 59.76 Favored 'General case' 0 C--N 1.316 -0.891 0 CA-C-N 114.607 -1.179 . . . . 0.0 112.075 177.505 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 69.4 mtt85 -114.15 -22.74 9.85 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 179.536 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -165.82 164.53 37.46 Favored Glycine 0 N--CA 1.453 -0.214 0 N-CA-C 110.571 -1.012 . . . . 0.0 110.571 -178.633 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 10.6 m . . . . . 0 C--O 1.242 0.702 0 N-CA-C 113.561 0.948 . . . . 0.0 113.561 -176.838 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.767 0 CA-C-O 118.783 -0.627 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -66.22 -36.58 83.43 Favored 'General case' 0 C--O 1.222 -0.37 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 177.168 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 17.4 m -84.32 135.43 41.47 Favored Pre-proline 0 C--N 1.324 -0.53 0 N-CA-C 107.977 -1.12 . . . . 0.0 107.977 176.087 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.19 152.68 62.02 Favored 'Trans proline' 0 C--O 1.238 0.517 0 C-N-CA 118.224 -0.717 . . . . 0.0 113.234 179.211 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 6.8 m -73.21 162.88 28.88 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.481 -0.782 . . . . 0.0 111.777 -178.709 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.403 HG13 HD23 ' A' ' 506' ' ' LEU . 56.0 t -54.61 -47.18 72.71 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.792 0 N-CA-C 112.293 0.479 . . . . 0.0 112.293 -179.681 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.428 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -65.07 -33.78 76.86 Favored 'General case' 0 C--N 1.317 -0.847 0 N-CA-C 111.84 0.311 . . . . 0.0 111.84 -178.53 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -67.11 -41.74 85.72 Favored 'General case' 0 C--N 1.325 -0.471 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 178.97 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -72.43 -32.73 66.55 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.114 -0.948 . . . . 0.0 110.863 -177.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -57.42 -39.17 75.64 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-N 115.195 -0.911 . . . . 0.0 109.306 -179.541 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 83.3 mt-30 -53.76 -38.84 64.82 Favored 'General case' 0 C--N 1.326 -0.437 0 C-N-CA 120.677 -0.409 . . . . 0.0 110.969 -178.878 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -70.42 -55.38 9.19 Favored 'General case' 0 C--O 1.221 -0.414 0 C-N-CA 120.418 -0.513 . . . . 0.0 110.444 176.424 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.9 -45.89 82.31 Favored 'General case' 0 C--O 1.216 -0.691 0 N-CA-C 114.35 1.241 . . . . 0.0 114.35 -176.397 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 17.9 t-160 -62.02 -38.79 90.0 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 108.926 -0.768 . . . . 0.0 108.926 -179.477 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 52.0 m -65.39 -41.31 93.81 Favored 'General case' 0 C--O 1.22 -0.451 0 C-N-CA 120.769 -0.372 . . . . 0.0 110.357 178.696 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 7.1 mm-40 -63.81 -42.41 97.68 Favored 'General case' 0 CA--C 1.504 -0.797 0 CA-C-N 117.938 0.336 . . . . 0.0 111.255 178.742 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.6 mt -54.52 -46.74 71.73 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 N-CA-C 107.662 -1.236 . . . . 0.0 107.662 177.329 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 50.1 mtpt -68.14 -38.63 82.39 Favored 'General case' 0 C--N 1.321 -0.655 0 N-CA-C 113.278 0.844 . . . . 0.0 113.278 -177.163 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -66.58 -32.68 74.18 Favored 'General case' 0 C--N 1.323 -0.551 0 N-CA-C 109.809 -0.441 . . . . 0.0 109.809 177.934 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.78 -19.41 65.88 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 112.234 0.457 . . . . 0.0 112.234 178.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 21.6 mt -104.11 12.1 34.36 Favored 'General case' 0 C--N 1.325 -0.474 0 N-CA-C 112.408 0.522 . . . . 0.0 112.408 179.709 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 13.4 mtpt -56.47 129.44 40.73 Favored 'General case' 0 C--O 1.208 -1.114 0 N-CA-C 107.394 -1.336 . . . . 0.0 107.394 178.126 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 57.0 t -62.41 -39.84 85.82 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.69 0 CA-C-O 122.44 1.114 . . . . 0.0 108.242 177.229 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -65.36 -28.75 69.5 Favored 'General case' 0 C--N 1.318 -0.77 0 CA-C-N 113.272 -1.786 . . . . 0.0 113.165 -179.506 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 95.9 p -163.03 76.68 1.87 Allowed Pre-proline 0 C--O 1.241 0.627 0 N-CA-C 112.392 0.516 . . . . 0.0 112.392 -178.017 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -70.82 144.97 49.78 Favored 'Trans proline' 0 CA--C 1.532 0.401 0 C-N-CA 114.701 -3.066 . . . . 0.0 111.895 179.469 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.1 t0 -137.21 91.53 2.62 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 121.755 0.788 . . . . 0.0 110.228 -174.851 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.414 HG12 ' H ' ' A' ' 493' ' ' VAL . 1.0 OUTLIER -57.29 -45.65 85.06 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.747 0 N-CA-C 113.602 0.964 . . . . 0.0 113.602 -177.636 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 87.9 mttt -59.72 -30.47 68.84 Favored 'General case' 0 CA--C 1.508 -0.641 0 N-CA-C 110.256 -0.276 . . . . 0.0 110.256 -178.0 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.5 ttm-85 -71.01 -41.64 70.65 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 -178.501 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.476 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.23 -48.31 76.32 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 108.27 -1.011 . . . . 0.0 108.27 176.458 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 94.0 mt -57.64 -42.55 83.65 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-N 117.627 0.194 . . . . 0.0 111.464 -177.343 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 13.6 t-20 -64.8 -39.1 93.04 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-O 121.3 0.572 . . . . 0.0 111.25 178.382 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.402 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -65.82 -48.67 70.91 Favored 'General case' 0 C--N 1.322 -0.605 0 N-CA-C 109.249 -0.649 . . . . 0.0 109.249 177.995 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.476 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -58.53 -44.57 89.62 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.674 -0.694 . . . . 0.0 112.505 178.822 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -64.27 -33.18 75.22 Favored 'General case' 0 C--N 1.322 -0.614 0 CA-C-N 119.086 0.857 . . . . 0.0 111.544 -177.085 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.0 -50.85 37.52 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 106.074 -1.825 . . . . 0.0 106.074 175.065 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -51.27 -30.72 18.74 Favored 'General case' 0 N--CA 1.472 0.659 0 CA-C-O 121.211 0.529 . . . . 0.0 112.308 -177.479 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -65.64 -28.03 73.21 Favored Glycine 0 C--O 1.24 0.501 0 N-CA-C 114.91 0.724 . . . . 0.0 114.91 177.608 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 9.0 t -100.36 -25.94 14.05 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 117.322 0.561 . . . . 0.0 110.67 -177.844 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.403 HD23 HG13 ' A' ' 471' ' ' VAL . 3.0 mp -56.11 137.11 52.07 Favored 'General case' 0 N--CA 1.443 -0.82 0 O-C-N 121.789 -0.569 . . . . 0.0 112.389 174.825 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.449 ' O ' HD13 ' A' ' 512' ' ' ILE . 30.3 tt0 -78.97 80.23 5.33 Favored 'General case' 0 C--O 1.217 -0.61 0 CA-C-O 122.588 1.185 . . . . 0.0 109.795 -179.422 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.817 HG21 HD22 ' A' ' 546' ' ' LEU . 30.9 m -93.33 49.76 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.308 -1.234 0 CA-C-O 123.248 1.499 . . . . 0.0 108.081 -179.731 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 10.6 t -66.96 174.95 2.72 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 113.859 -1.518 . . . . 0.0 107.122 179.897 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 21.0 m -49.29 -36.16 20.05 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -173.577 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 56.1 tt0 -53.72 -44.54 69.94 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.326 0.491 . . . . 0.0 112.326 178.42 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.449 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.3 mp -88.57 -40.29 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 -179.33 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.436 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.71 -39.81 81.89 Favored 'General case' 0 C--N 1.32 -0.692 0 N-CA-C 113.147 0.795 . . . . 0.0 113.147 -176.261 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 -68.89 -31.09 69.76 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.757 -0.202 . . . . 0.0 111.358 -178.375 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.1 ptmt -90.04 -2.38 58.11 Favored 'General case' 0 N--CA 1.47 0.54 0 O-C-N 122.235 -0.291 . . . . 0.0 111.328 177.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 43.1 m-80 -129.91 46.51 2.64 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-O 121.698 0.761 . . . . 0.0 111.802 179.046 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 19.2 p -64.6 -28.83 69.89 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 121.713 -0.617 . . . . 0.0 112.307 -179.29 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 20.4 m-20 -65.41 -28.56 69.34 Favored 'General case' 0 N--CA 1.471 0.579 0 CA-C-O 121.393 0.616 . . . . 0.0 111.715 177.851 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 59.5 t -68.9 -44.52 81.57 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.653 0 N-CA-C 107.095 -1.446 . . . . 0.0 107.095 178.782 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 34.4 t -62.56 -36.36 74.67 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.502 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 179.211 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.6 -40.1 95.88 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-O 119.345 -0.36 . . . . 0.0 110.7 177.309 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 93.6 m -72.77 -39.71 66.55 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-N 118.704 0.684 . . . . 0.0 110.532 179.991 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.665 HD23 HD11 ' A' ' 526' ' ' ILE . 68.9 mt -57.76 -35.02 70.19 Favored 'General case' 0 C--N 1.321 -0.655 0 CA-C-O 120.903 0.382 . . . . 0.0 111.133 178.828 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.4 mtmt -65.41 -29.05 69.71 Favored 'General case' 0 N--CA 1.469 0.505 0 O-C-N 121.691 -0.631 . . . . 0.0 111.527 175.928 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 83.6 mttt -73.05 -46.03 54.09 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-O 121.022 0.439 . . . . 0.0 110.798 179.446 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.665 HD11 HD23 ' A' ' 523' ' ' LEU . 15.2 pt -77.39 -21.44 14.19 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.951 0 N-CA-C 114.822 1.416 . . . . 0.0 114.822 -175.843 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.469 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -62.49 -18.86 62.81 Favored 'General case' 0 C--O 1.212 -0.888 0 O-C-N 121.94 -0.475 . . . . 0.0 111.422 175.89 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.77 18.98 13.27 Favored 'General case' 0 N--CA 1.469 0.489 0 C-N-CA 122.846 0.458 . . . . 0.0 111.101 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -63.04 119.95 10.47 Favored 'General case' 0 C--O 1.221 -0.41 0 C-N-CA 122.612 0.365 . . . . 0.0 110.69 -178.479 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt -88.45 -23.29 23.31 Favored 'General case' 0 C--O 1.217 -0.616 0 N-CA-C 115.437 1.643 . . . . 0.0 115.437 -175.598 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -66.01 -41.22 91.31 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.245 0.545 . . . . 0.0 110.993 -177.641 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.6 m120 -130.8 112.64 13.23 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-N 116.15 -0.477 . . . . 0.0 109.91 -179.048 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 32.7 tptt -56.78 -43.65 81.06 Favored 'General case' 0 C--O 1.208 -1.124 0 CA-C-N 116.571 -0.286 . . . . 0.0 110.889 179.086 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 5.9 t0 -55.79 -41.86 74.72 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.475 0.546 . . . . 0.0 112.475 -176.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 71.2 t -58.19 -43.33 85.45 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.444 0 N-CA-C 109.242 -0.651 . . . . 0.0 109.242 178.092 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.6 ttp -64.17 -44.03 93.32 Favored 'General case' 0 CA--C 1.511 -0.522 0 N-CA-C 109.761 -0.459 . . . . 0.0 109.761 179.786 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -63.56 -48.91 75.52 Favored 'General case' 0 C--N 1.323 -0.574 0 C-N-CA 120.683 -0.407 . . . . 0.0 111.958 -179.606 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 39.4 tptt -70.54 -39.04 74.23 Favored 'General case' 0 C--O 1.222 -0.367 0 C-N-CA 118.717 -1.193 . . . . 0.0 111.132 -177.516 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.43 -39.56 83.93 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 121.355 0.598 . . . . 0.0 109.789 178.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.469 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.58 -46.2 83.74 Favored 'General case' 0 C--N 1.314 -0.939 0 CA-C-N 115.28 -0.873 . . . . 0.0 113.172 178.745 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.36 -40.42 90.67 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.006 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 55.6 t -70.68 -53.62 21.45 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.032 0 CA-C-N 116.031 -0.531 . . . . 0.0 111.359 -178.793 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.4 t80 -53.94 -44.94 71.09 Favored 'General case' 0 C--N 1.323 -0.575 0 C-N-CA 122.293 0.237 . . . . 0.0 110.734 -175.027 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 28.0 m -64.2 -38.79 92.33 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 123.203 0.601 . . . . 0.0 111.125 179.136 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 40.6 mtt85 -61.91 -30.65 71.04 Favored 'General case' 0 C--O 1.214 -0.791 0 O-C-N 121.748 -0.595 . . . . 0.0 110.909 176.923 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.817 HD22 HG21 ' A' ' 508' ' ' VAL . 5.8 mt -75.6 -31.73 60.05 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 108.082 -1.081 . . . . 0.0 108.082 -177.149 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.52 -36.57 78.72 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 115.252 -0.886 . . . . 0.0 108.974 176.014 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.4 m -81.73 -15.05 55.6 Favored 'General case' 0 CA--C 1.539 0.534 0 N-CA-C 114.441 1.274 . . . . 0.0 114.441 177.02 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 90.2 mtt-85 -91.98 -18.39 23.74 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 121.916 -0.49 . . . . 0.0 111.761 -179.852 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -123.16 -172.35 13.83 Favored Glycine 0 C--O 1.226 -0.404 0 N-CA-C 109.876 -1.29 . . . . 0.0 109.876 -178.0 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.246 0.871 0 C-N-CA 124.548 1.139 . . . . 0.0 108.699 -177.383 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.543 0 N-CA-C 109.659 -0.497 . . . . 0.0 109.659 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -74.29 166.07 24.09 Favored 'General case' 0 C--N 1.327 -0.382 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 177.29 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 22.9 t -144.71 142.37 18.91 Favored Pre-proline 0 C--N 1.323 -0.576 0 N-CA-C 105.263 -2.125 . . . . 0.0 105.263 177.662 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 63.9 Cg_endo -67.46 152.74 78.27 Favored 'Trans proline' 0 C--O 1.241 0.632 0 C-N-CA 117.983 -0.878 . . . . 0.0 113.4 -179.306 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.6 m -67.09 166.18 14.37 Favored 'General case' 0 C--N 1.323 -0.558 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.478 179.948 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.407 HG13 ' HB3' ' A' ' 506' ' ' LEU . 45.2 t -55.43 -46.17 78.53 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.047 0 O-C-N 122.212 -0.305 . . . . 0.0 111.543 179.095 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.418 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -64.69 -35.25 80.43 Favored 'General case' 0 C--N 1.318 -0.767 0 N-CA-C 111.743 0.275 . . . . 0.0 111.743 -177.529 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.4 mt-10 -66.56 -42.08 87.62 Favored 'General case' 0 C--N 1.324 -0.527 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 177.84 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 13.6 mttt -69.22 -38.12 78.38 Favored 'General case' 0 CA--C 1.509 -0.627 0 CA-C-O 121.546 0.688 . . . . 0.0 109.503 -179.154 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.613 HD21 HG21 ' A' ' 519' ' ' VAL . 4.5 tt -57.73 -35.58 70.88 Favored 'General case' 0 C--O 1.209 -1.045 0 CA-C-N 114.797 -1.092 . . . . 0.0 109.727 179.424 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 80.7 mt-30 -57.58 -41.31 80.89 Favored 'General case' 0 C--N 1.326 -0.419 0 CA-C-N 119.366 0.984 . . . . 0.0 110.402 178.066 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 79.4 tttt -67.39 -53.22 31.19 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 120.321 -0.552 . . . . 0.0 109.721 178.427 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.4 -45.22 88.81 Favored 'General case' 0 C--O 1.218 -0.577 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -177.892 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.464 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.0 t-160 -58.17 -44.8 88.15 Favored 'General case' 0 C--N 1.319 -0.728 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -179.846 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.1 m -62.69 -39.07 92.84 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 111.59 0.219 . . . . 0.0 111.59 -179.125 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.415 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 13.3 mm-40 -64.11 -37.62 88.12 Favored 'General case' 0 CA--C 1.505 -0.764 0 C-N-CA 120.516 -0.473 . . . . 0.0 110.49 178.346 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.4 mt -59.09 -43.39 89.1 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.954 0 N-CA-C 106.996 -1.483 . . . . 0.0 106.996 178.845 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -63.04 -45.32 92.81 Favored 'General case' 0 N--CA 1.477 0.923 0 O-C-N 122.127 -0.358 . . . . 0.0 111.855 -179.485 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 28.0 m-85 -65.71 -33.24 75.41 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-O 120.734 0.302 . . . . 0.0 111.121 -178.524 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.15 -15.99 64.05 Favored 'General case' 0 C--N 1.321 -0.637 0 N-CA-C 112.335 0.495 . . . . 0.0 112.335 179.37 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 36.0 mt -111.87 12.1 20.82 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 112.027 0.381 . . . . 0.0 112.027 -177.914 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 11.0 mtpt -54.23 129.48 35.22 Favored 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 106.397 -1.705 . . . . 0.0 106.397 177.434 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.5 t -60.39 -40.33 83.73 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.717 0 CA-C-O 122.73 1.253 . . . . 0.0 107.893 177.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -68.84 -24.63 64.39 Favored 'General case' 0 C--N 1.318 -0.787 0 CA-C-N 112.959 -1.928 . . . . 0.0 113.348 179.944 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 7.1 m -159.58 71.74 3.3 Favored Pre-proline 0 N--CA 1.475 0.788 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -176.778 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_endo -71.49 139.82 35.2 Favored 'Trans proline' 0 CA--C 1.535 0.533 0 C-N-CA 114.142 -3.438 . . . . 0.0 112.006 179.144 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 60.2 t0 -137.14 95.85 3.18 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-O 121.529 0.681 . . . . 0.0 111.583 -177.649 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.409 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.5 OUTLIER -55.12 -48.88 75.64 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.773 0 N-CA-C 115.105 1.52 . . . . 0.0 115.105 -176.871 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 19.8 pttm -58.61 -32.55 69.11 Favored 'General case' 0 CA--C 1.497 -1.081 0 CA-C-O 122.533 1.159 . . . . 0.0 110.503 -175.566 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.9 ttt180 -67.86 -42.17 81.75 Favored 'General case' 0 C--N 1.312 -1.054 0 CA-C-N 113.282 -1.781 . . . . 0.0 109.194 -178.144 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.4 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.8 -48.34 74.79 Favored 'General case' 0 C--O 1.215 -0.725 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 175.733 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 75.5 mt -56.76 -43.19 80.55 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.01 0.374 . . . . 0.0 112.01 -176.125 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.9 t-20 -64.64 -38.77 92.15 Favored 'General case' 0 C--N 1.323 -0.557 0 CA-C-O 121.639 0.733 . . . . 0.0 111.95 179.384 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -69.85 -44.87 69.0 Favored 'General case' 0 C--N 1.319 -0.75 0 CA-C-O 121.468 0.652 . . . . 0.0 109.551 179.333 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.4 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.05 -49.8 72.73 Favored 'General case' 0 N--CA 1.428 -1.564 0 CA-C-N 115.083 -0.962 . . . . 0.0 110.463 177.224 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -62.4 -34.86 77.56 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 113.931 1.085 . . . . 0.0 113.931 -175.376 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 11.9 tp10 -67.8 -48.22 66.88 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 107.81 -1.181 . . . . 0.0 107.81 176.367 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -57.32 -32.21 66.46 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.395 -0.82 . . . . 0.0 110.291 -179.983 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.6 -15.66 66.64 Favored Glycine 0 N--CA 1.453 -0.222 0 CA-C-O 119.104 -0.831 . . . . 0.0 114.382 179.129 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 14.5 t -114.54 -13.72 12.16 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-N 118.482 1.141 . . . . 0.0 110.968 179.518 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.407 ' HB3' HG13 ' A' ' 471' ' ' VAL . 4.0 mt -67.29 148.25 51.93 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.818 -0.551 . . . . 0.0 110.558 179.472 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 25.2 tt0 -77.83 84.41 4.14 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 122.738 1.256 . . . . 0.0 109.936 178.261 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.911 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -98.35 50.11 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 CA-C-O 123.228 1.489 . . . . 0.0 109.138 -177.597 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.1 t -68.58 171.89 6.97 Favored 'General case' 0 C--N 1.315 -0.932 0 N-CA-C 106.567 -1.642 . . . . 0.0 106.567 -179.195 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -49.28 -33.49 13.14 Favored 'General case' 0 C--O 1.218 -0.596 0 N-CA-C 113.425 0.898 . . . . 0.0 113.425 -174.109 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 45.3 tt0 -54.19 -44.39 71.51 Favored 'General case' 0 C--O 1.219 -0.535 0 N-CA-C 111.441 0.163 . . . . 0.0 111.441 178.378 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.5 mp -88.52 -43.13 15.15 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.48 0 CA-C-O 121.337 0.589 . . . . 0.0 110.088 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.526 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.9 -40.37 84.26 Favored 'General case' 0 C--N 1.318 -0.779 0 N-CA-C 113.917 1.08 . . . . 0.0 113.917 -175.527 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -71.14 -28.64 64.43 Favored 'General case' 0 C--N 1.321 -0.661 0 CA-C-N 116.322 -0.399 . . . . 0.0 111.136 -176.35 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -89.76 -5.55 56.85 Favored 'General case' 0 N--CA 1.47 0.539 0 O-C-N 122.332 -0.23 . . . . 0.0 111.169 176.903 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 51.2 m-80 -127.44 42.55 3.3 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 121.854 0.835 . . . . 0.0 112.505 179.93 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 17.8 p -63.86 -24.01 67.58 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 113.303 0.853 . . . . 0.0 113.303 -179.264 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.54 -32.27 73.85 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 122.314 1.054 . . . . 0.0 112.213 178.293 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.613 HG21 HD21 ' A' ' 475' ' ' LEU . 61.3 t -69.6 -42.58 80.62 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.783 0 N-CA-C 107.305 -1.368 . . . . 0.0 107.305 179.118 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 48.5 t -63.2 -37.47 79.51 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.501 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 178.079 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -63.41 -33.13 74.88 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 116.306 -0.406 . . . . 0.0 110.655 178.029 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 86.7 m -79.29 -39.38 33.08 Favored 'General case' 0 C--O 1.218 -0.567 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 179.904 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.526 HD23 HD11 ' A' ' 526' ' ' ILE . 40.7 mt -57.43 -34.7 69.22 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-O 120.985 0.421 . . . . 0.0 111.431 178.22 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.8 mtmt -63.87 -29.2 70.41 Favored 'General case' 0 N--CA 1.468 0.46 0 O-C-N 121.781 -0.574 . . . . 0.0 111.568 175.157 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.6 mttt -74.77 -43.34 55.33 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-O 120.603 0.239 . . . . 0.0 111.611 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.526 HD11 HD23 ' A' ' 523' ' ' LEU . 0.7 OUTLIER -78.78 -21.82 12.93 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.952 0 N-CA-C 114.747 1.388 . . . . 0.0 114.747 -177.373 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.418 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -60.65 -17.91 50.3 Favored 'General case' 0 C--O 1.211 -0.924 0 O-C-N 122.032 -0.417 . . . . 0.0 112.091 176.357 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 8.8 ptm180 -118.71 19.35 13.21 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.053 0.541 . . . . 0.0 111.269 178.005 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 13.4 t80 -65.7 115.34 5.76 Favored 'General case' 0 C--N 1.326 -0.448 0 CA-C-O 121.167 0.508 . . . . 0.0 111.46 -176.968 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -82.91 -23.6 33.46 Favored 'General case' 0 C--O 1.217 -0.607 0 N-CA-C 115.756 1.762 . . . . 0.0 115.756 -176.488 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -65.54 -40.33 92.78 Favored 'General case' 0 C--N 1.327 -0.404 0 C-N-CA 120.425 -0.51 . . . . 0.0 110.972 -177.093 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.4 m120 -133.22 113.23 12.43 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-N 116.227 -0.442 . . . . 0.0 109.87 -178.773 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.1 tptt -56.05 -44.66 79.06 Favored 'General case' 0 C--O 1.207 -1.158 0 CA-C-N 116.599 -0.273 . . . . 0.0 110.565 178.728 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 6.6 t0 -55.32 -43.15 74.65 Favored 'General case' 0 C--N 1.323 -0.567 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 -176.731 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 76.0 t -57.91 -43.93 85.56 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.555 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 177.477 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -62.97 -44.69 95.36 Favored 'General case' 0 CA--C 1.51 -0.578 0 CA-C-O 119.333 -0.365 . . . . 0.0 110.04 179.414 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.91 -47.51 77.5 Favored 'General case' 0 C--N 1.323 -0.586 0 N-CA-C 112.249 0.463 . . . . 0.0 112.249 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 34.5 tptt -69.33 -39.24 78.32 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 119.115 -1.034 . . . . 0.0 111.28 -178.759 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.92 85.94 Favored 'General case' 0 C--O 1.213 -0.847 0 N-CA-C 108.838 -0.801 . . . . 0.0 108.838 178.263 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.418 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.73 -48.82 75.47 Favored 'General case' 0 C--N 1.315 -0.926 0 CA-C-N 114.774 -1.103 . . . . 0.0 113.142 178.863 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.29 -43.32 92.6 Favored 'General case' 0 C--N 1.319 -0.725 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -179.841 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 78.8 t -68.94 -50.55 53.06 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.877 0 CA-C-N 116.24 -0.436 . . . . 0.0 111.162 -178.416 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 59.1 t80 -55.03 -43.86 74.09 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-O 120.611 0.243 . . . . 0.0 110.446 -177.692 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 16.5 m -67.57 -35.82 79.74 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 122.641 0.377 . . . . 0.0 111.123 179.265 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -59.52 -31.85 69.77 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 176.182 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.911 HD22 HG21 ' A' ' 508' ' ' VAL . 5.5 mt -75.08 -36.73 61.72 Favored 'General case' 0 CA--C 1.507 -0.704 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 -176.327 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.0 mmpt? -56.45 -37.68 70.62 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 115.315 -0.857 . . . . 0.0 110.629 179.429 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 13.8 m -75.12 -8.5 56.75 Favored 'General case' 0 C--N 1.322 -0.598 0 N-CA-C 114.177 1.177 . . . . 0.0 114.177 178.421 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 94.6 mtt180 -114.6 -30.04 6.63 Favored 'General case' 0 N--CA 1.475 0.78 0 N-CA-C 114.127 1.158 . . . . 0.0 114.127 -176.858 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -162.47 35.13 0.34 Allowed Glycine 0 C--O 1.233 0.08 0 C-N-CA 120.893 -0.67 . . . . 0.0 114.017 -178.978 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 29.8 m . . . . . 0 C--O 1.25 1.091 0 C-N-CA 123.72 0.808 . . . . 0.0 111.686 -177.239 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.569 0 N-CA-C 109.789 -0.449 . . . . 0.0 109.789 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -73.26 162.57 29.22 Favored 'General case' 0 C--N 1.326 -0.417 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 176.873 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 22.7 m -73.79 138.63 76.76 Favored Pre-proline 0 C--N 1.323 -0.579 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 177.677 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -70.83 148.74 58.8 Favored 'Trans proline' 0 C--O 1.239 0.541 0 C-N-CA 117.742 -1.039 . . . . 0.0 113.645 -179.413 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.4 m -68.54 164.28 21.64 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.784 179.46 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . 0.427 HG13 ' HB3' ' A' ' 506' ' ' LEU . 32.7 t -53.89 -47.6 63.92 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.067 0 O-C-N 122.007 -0.433 . . . . 0.0 111.97 179.399 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.2 pt-20 -62.31 -33.68 75.13 Favored 'General case' 0 C--N 1.317 -0.807 0 N-CA-C 111.991 0.367 . . . . 0.0 111.991 -178.428 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 50.9 mt-10 -67.28 -40.8 86.16 Favored 'General case' 0 CA--C 1.51 -0.581 0 N-CA-C 107.636 -1.246 . . . . 0.0 107.636 -179.565 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 55.7 mtpt -74.21 -35.58 63.92 Favored 'General case' 0 CA--C 1.507 -0.699 0 CA-C-N 114.872 -1.058 . . . . 0.0 110.409 -178.034 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.622 HD21 HG21 ' A' ' 519' ' ' VAL . 3.7 tt -58.63 -37.2 75.39 Favored 'General case' 0 C--O 1.206 -1.197 0 CA-C-N 114.803 -1.09 . . . . 0.0 109.237 178.369 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -59.07 -40.85 86.49 Favored 'General case' 0 C--N 1.325 -0.459 0 CA-C-N 119.036 0.835 . . . . 0.0 110.61 178.422 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 78.5 tttt -64.82 -53.13 51.7 Favored 'General case' 0 N--CA 1.469 0.492 0 N-CA-C 109.505 -0.554 . . . . 0.0 109.505 177.789 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.79 -44.57 93.89 Favored 'General case' 0 CA--C 1.507 -0.691 0 N-CA-C 112.624 0.601 . . . . 0.0 112.624 -178.079 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.424 ' CG ' HG22 ' A' ' 519' ' ' VAL . 16.4 t-160 -57.9 -44.79 86.99 Favored 'General case' 0 C--O 1.216 -0.703 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 -178.898 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 50.7 m -62.77 -39.63 94.8 Favored 'General case' 0 C--N 1.329 -0.308 0 O-C-N 123.181 0.301 . . . . 0.0 111.622 -179.325 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 14.4 mm-40 -64.41 -37.25 86.86 Favored 'General case' 0 CA--C 1.504 -0.81 0 C-N-CA 120.448 -0.501 . . . . 0.0 110.625 178.337 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 95.8 mt -59.14 -43.47 89.48 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.031 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 178.872 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 20.7 mmtt -63.68 -46.02 87.43 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 -179.37 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -64.81 -33.04 75.05 Favored 'General case' 0 C--O 1.221 -0.433 0 CA-C-O 120.8 0.333 . . . . 0.0 111.16 -178.246 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.59 -17.55 64.67 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 179.958 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 24.2 mt -111.89 12.05 20.8 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 113.436 0.902 . . . . 0.0 113.436 -177.091 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 5.1 ptmm? -66.76 133.38 50.02 Favored 'General case' 0 C--O 1.218 -0.566 0 N-CA-C 107.382 -1.34 . . . . 0.0 107.382 179.932 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 40.4 t -56.89 -39.14 63.07 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.813 0 CA-C-O 122.079 0.942 . . . . 0.0 111.326 -177.246 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -63.02 -30.24 71.44 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 113.978 -1.465 . . . . 0.0 113.381 -177.706 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 2.2 m -164.53 78.62 1.43 Allowed Pre-proline 0 N--CA 1.479 0.986 0 N-CA-C 112.039 0.385 . . . . 0.0 112.039 -179.399 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -69.96 147.52 61.75 Favored 'Trans proline' 0 CA--C 1.537 0.658 0 C-N-CA 115.732 -2.379 . . . . 0.0 112.339 177.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.8 t0 -137.3 99.57 4.01 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.672 0.748 . . . . 0.0 110.118 -179.386 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.7 OUTLIER -57.22 -47.26 84.49 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.779 0 N-CA-C 113.69 0.996 . . . . 0.0 113.69 -178.355 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -57.94 -32.62 67.97 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 121.99 0.9 . . . . 0.0 109.989 -176.74 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -69.52 -41.37 76.09 Favored 'General case' 0 C--N 1.317 -0.818 0 CA-C-N 114.268 -1.333 . . . . 0.0 108.933 -176.543 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.405 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.57 -49.81 67.48 Favored 'General case' 0 C--O 1.217 -0.646 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 176.096 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 81.2 mt -56.45 -43.07 79.16 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -176.286 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 -64.35 -38.27 90.44 Favored 'General case' 0 C--N 1.323 -0.582 0 CA-C-O 121.64 0.733 . . . . 0.0 112.07 -179.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -72.1 -44.81 62.64 Favored 'General case' 0 C--N 1.319 -0.721 0 O-C-N 121.722 -0.612 . . . . 0.0 109.642 178.449 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.405 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -54.59 -48.09 72.55 Favored 'General case' 0 N--CA 1.427 -1.616 0 CA-C-N 115.874 -0.603 . . . . 0.0 110.542 177.205 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.1 pt-20 -62.55 -35.76 80.48 Favored 'General case' 0 C--N 1.322 -0.595 0 N-CA-C 113.951 1.093 . . . . 0.0 113.951 -176.17 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 19.7 tp10 -67.84 -48.97 64.69 Favored 'General case' 0 CA--C 1.513 -0.465 0 N-CA-C 107.912 -1.144 . . . . 0.0 107.912 176.395 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.66 -33.63 64.25 Favored 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 114.808 -1.087 . . . . 0.0 109.88 -179.526 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.71 -17.77 69.49 Favored Glycine 0 C--O 1.236 0.276 0 N-CA-C 115.165 0.826 . . . . 0.0 115.165 179.309 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.9 t -111.08 -12.77 14.14 Favored 'General case' 0 C--N 1.326 -0.42 0 CA-C-N 118.064 0.932 . . . . 0.0 110.484 -179.584 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . 0.427 ' HB3' HG13 ' A' ' 471' ' ' VAL . 5.2 mt -67.71 148.15 51.69 Favored 'General case' 0 C--N 1.327 -0.379 0 O-C-N 121.979 -0.451 . . . . 0.0 110.462 -179.884 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.417 ' O ' HD13 ' A' ' 512' ' ' ILE . 37.4 tt0 -78.59 84.46 4.71 Favored 'General case' 0 C--O 1.217 -0.614 0 CA-C-O 122.841 1.305 . . . . 0.0 109.078 177.655 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.876 HG21 HD22 ' A' ' 546' ' ' LEU . 30.3 m -99.97 48.37 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 CA-C-O 123.087 1.422 . . . . 0.0 108.477 -177.875 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.4 t -67.06 172.45 4.55 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 106.784 -1.561 . . . . 0.0 106.784 -179.602 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 24.1 m -49.23 -32.19 10.14 Favored 'General case' 0 C--O 1.214 -0.809 0 N-CA-C 113.139 0.792 . . . . 0.0 113.139 -174.419 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 60.2 tt0 -54.48 -44.95 73.08 Favored 'General case' 0 C--N 1.323 -0.552 0 N-CA-C 111.676 0.25 . . . . 0.0 111.676 178.169 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.417 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -88.68 -42.6 14.79 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.467 0 CA-C-O 121.261 0.553 . . . . 0.0 109.656 179.388 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.523 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.85 -40.07 83.16 Favored 'General case' 0 C--N 1.319 -0.721 0 N-CA-C 113.693 0.998 . . . . 0.0 113.693 -175.196 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -70.53 -28.95 65.33 Favored 'General case' 0 C--N 1.322 -0.604 0 C-N-CA 120.804 -0.358 . . . . 0.0 111.192 -176.875 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -90.54 -4.25 57.03 Favored 'General case' 0 N--CA 1.469 0.51 0 O-C-N 122.364 -0.21 . . . . 0.0 111.171 177.23 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 49.4 m-80 -128.24 43.02 3.22 Favored 'General case' 0 N--CA 1.469 0.524 0 CA-C-O 121.674 0.75 . . . . 0.0 112.361 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 18.7 p -63.44 -24.34 67.79 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 113.112 0.782 . . . . 0.0 113.112 -178.833 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 -65.64 -30.61 71.34 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-O 121.527 0.679 . . . . 0.0 112.158 178.077 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.622 HG21 HD21 ' A' ' 475' ' ' LEU . 42.7 t -71.18 -41.55 75.37 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.645 0 N-CA-C 107.262 -1.385 . . . . 0.0 107.262 178.402 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 38.1 t -62.99 -37.67 79.96 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.572 0 N-CA-C 108.261 -1.014 . . . . 0.0 108.261 178.616 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.08 -34.52 78.23 Favored 'General case' 0 C--N 1.324 -0.514 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.447 177.7 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 90.7 m -77.1 -39.76 48.39 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 -179.668 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.54 HD23 HD11 ' A' ' 526' ' ' ILE . 47.0 mt -58.36 -35.52 72.08 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.261 0.553 . . . . 0.0 110.933 178.87 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.5 mtmt -64.56 -29.08 70.1 Favored 'General case' 0 CA--C 1.54 0.579 0 O-C-N 121.998 -0.439 . . . . 0.0 111.343 175.246 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 63.0 mttm -72.91 -45.33 58.73 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 117.839 0.29 . . . . 0.0 111.472 178.391 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.54 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -77.66 -21.68 13.96 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 114.914 1.45 . . . . 0.0 114.914 -176.215 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.424 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.2 OUTLIER -61.19 -18.32 57.65 Favored 'General case' 0 C--O 1.211 -0.958 0 O-C-N 122.132 -0.355 . . . . 0.0 111.895 176.452 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.1 ptm180 -118.74 19.45 13.16 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.025 0.53 . . . . 0.0 112.042 176.537 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.405 ' CE2' ' HB3' ' A' ' 531' ' ' ALA . 11.2 t80 -60.96 118.18 6.4 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 121.236 0.541 . . . . 0.0 112.24 -177.263 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 95.5 mttt -74.04 -33.18 63.64 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 115.283 1.586 . . . . 0.0 115.283 -176.672 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.405 ' HB3' ' CE2' ' A' ' 529' ' ' TYR . . . -67.01 -41.9 85.86 Favored 'General case' 0 C--N 1.324 -0.532 0 N-CA-C 113.403 0.89 . . . . 0.0 113.403 -172.975 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.0 m120 -131.91 117.2 18.16 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 122.314 -0.241 . . . . 0.0 110.867 -177.811 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 43.4 tptt -57.7 -46.63 84.08 Favored 'General case' 0 C--O 1.206 -1.186 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.517 178.165 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -55.64 -42.66 75.3 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 112.48 0.548 . . . . 0.0 112.48 -176.383 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 72.2 t -56.73 -44.47 81.6 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.521 0 N-CA-C 109.704 -0.48 . . . . 0.0 109.704 177.242 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.9 ttp -64.29 -43.86 93.45 Favored 'General case' 0 CA--C 1.511 -0.526 0 CA-C-O 119.151 -0.452 . . . . 0.0 110.036 179.435 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.3 mm-40 -64.7 -47.32 78.78 Favored 'General case' 0 C--N 1.324 -0.542 0 C-N-CA 120.377 -0.529 . . . . 0.0 112.092 -179.911 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.9 tptt -69.65 -39.14 77.25 Favored 'General case' 0 C--O 1.221 -0.418 0 C-N-CA 119.148 -1.021 . . . . 0.0 111.104 -179.138 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.1 -39.92 83.71 Favored 'General case' 0 C--O 1.211 -0.947 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 178.414 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.424 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -64.88 -49.54 70.08 Favored 'General case' 0 C--N 1.314 -0.937 0 CA-C-N 114.922 -1.036 . . . . 0.0 113.18 179.081 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.19 -42.6 91.25 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 108.906 -0.775 . . . . 0.0 108.906 179.983 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.8 t -70.6 -50.09 47.42 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.991 0 CA-C-N 115.925 -0.58 . . . . 0.0 111.464 -177.93 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.3 t80 -55.35 -45.11 76.46 Favored 'General case' 0 C--N 1.32 -0.704 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 -177.999 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.6 m -66.75 -34.77 78.58 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-O 121.399 0.618 . . . . 0.0 111.186 179.55 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 12.3 mtt85 -60.71 -29.77 69.54 Favored 'General case' 0 C--N 1.324 -0.522 0 O-C-N 121.864 -0.522 . . . . 0.0 109.967 175.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.876 HD22 HG21 ' A' ' 508' ' ' VAL . 8.8 mt -76.52 -35.3 58.39 Favored 'General case' 0 C--O 1.209 -1.042 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 -176.134 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.81 -28.93 70.34 Favored 'General case' 0 C--O 1.215 -0.718 0 CA-C-N 115.131 -0.941 . . . . 0.0 111.03 178.902 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 22.1 m -78.7 -8.59 58.85 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 114.718 -1.128 . . . . 0.0 111.905 178.385 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 77.8 mtt85 -115.4 -26.65 7.48 Favored 'General case' 0 N--CA 1.475 0.778 0 N-CA-C 113.233 0.827 . . . . 0.0 113.233 179.44 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -164.57 161.78 34.88 Favored Glycine 0 C--O 1.237 0.287 0 C-N-CA 121.522 -0.371 . . . . 0.0 112.443 -177.974 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 12.6 m . . . . . 0 C--O 1.241 0.655 0 CA-C-O 117.758 -1.115 . . . . 0.0 112.642 -177.909 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.955 0 CA-C-O 118.621 -0.704 . . . . 0.0 109.815 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . 68.4 -38.64 0.38 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 125.53 1.532 . . . . 0.0 112.738 -175.704 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 53.3 m -140.4 154.44 69.6 Favored Pre-proline 0 C--O 1.243 0.735 0 N-CA-C 105.71 -1.959 . . . . 0.0 105.71 174.133 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 86.7 Cg_endo -72.26 152.6 55.92 Favored 'Trans proline' 0 C--O 1.243 0.729 0 O-C-N 122.212 0.585 . . . . 0.0 113.561 179.259 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 10.5 m -72.13 168.94 17.12 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 115.564 -0.743 . . . . 0.0 111.263 179.305 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 56.7 t -57.37 -46.41 85.48 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.022 0 N-CA-C 112.112 0.412 . . . . 0.0 112.112 -179.432 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.414 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.3 pt-20 -65.49 -34.16 77.63 Favored 'General case' 0 C--N 1.317 -0.806 0 N-CA-C 111.934 0.346 . . . . 0.0 111.934 -178.572 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -65.24 -42.86 92.92 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 107.895 -1.15 . . . . 0.0 107.895 177.393 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 16.8 mttt -70.05 -34.61 73.45 Favored 'General case' 0 CA--C 1.509 -0.629 0 CA-C-N 115.492 -0.776 . . . . 0.0 110.041 -179.201 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -57.55 -40.43 78.88 Favored 'General case' 0 C--N 1.319 -0.723 0 CA-C-N 115.606 -0.724 . . . . 0.0 109.356 -178.552 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 86.0 mt-30 -55.01 -40.09 69.77 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 120.168 -0.613 . . . . 0.0 110.579 -179.213 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 53.3 tttt -67.94 -57.77 5.64 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 110.503 -0.184 . . . . 0.0 110.503 176.744 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.62 -45.52 89.02 Favored 'General case' 0 CA--C 1.505 -0.768 0 N-CA-C 114.098 1.147 . . . . 0.0 114.098 -176.126 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 16.8 t-160 -60.0 -42.28 93.92 Favored 'General case' 0 C--N 1.319 -0.74 0 N-CA-C 108.491 -0.929 . . . . 0.0 108.491 -179.325 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 61.8 m -62.64 -39.67 94.6 Favored 'General case' 0 C--N 1.331 -0.229 0 C-N-CA 120.837 -0.345 . . . . 0.0 110.998 -179.218 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.415 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.6 mm-40 -63.72 -37.85 88.89 Favored 'General case' 0 CA--C 1.508 -0.659 0 C-N-CA 120.581 -0.448 . . . . 0.0 111.077 178.431 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 93.8 mt -60.08 -42.53 90.24 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.022 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 179.368 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -64.81 -45.12 87.6 Favored 'General case' 0 N--CA 1.475 0.789 0 O-C-N 122.182 -0.324 . . . . 0.0 111.568 -179.452 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -66.2 -30.44 70.9 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 116.478 -0.328 . . . . 0.0 111.192 -178.185 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -67.73 -18.19 64.81 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 112.504 0.557 . . . . 0.0 112.504 178.604 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 35.2 mt -107.66 12.21 27.76 Favored 'General case' 0 C--N 1.325 -0.489 0 N-CA-C 111.815 0.302 . . . . 0.0 111.815 -177.985 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 62.1 mttt -55.23 135.87 49.25 Favored 'General case' 0 CA--C 1.494 -1.201 0 CA-C-O 121.697 0.761 . . . . 0.0 109.914 178.124 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 13.0 m -73.49 -21.45 18.63 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.963 0 CA-C-N 114.545 -1.207 . . . . 0.0 110.149 178.877 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -78.58 -31.18 47.11 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 113.798 -1.546 . . . . 0.0 111.251 -178.873 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 43.5 t -168.8 83.41 0.69 Allowed Pre-proline 0 C--O 1.238 0.483 0 CA-C-N 115.414 -0.812 . . . . 0.0 110.912 -175.831 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_endo -71.35 146.45 50.66 Favored 'Trans proline' 0 CA--C 1.531 0.362 0 C-N-CA 115.447 -2.569 . . . . 0.0 111.964 178.014 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.4 t0 -137.18 100.12 4.18 Favored 'General case' 0 C--N 1.326 -0.446 0 CA-C-O 121.857 0.837 . . . . 0.0 111.419 -178.839 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.443 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.6 OUTLIER -58.85 -44.2 90.0 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.817 0 N-CA-C 112.978 0.733 . . . . 0.0 112.978 -179.959 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -60.65 -31.82 71.02 Favored 'General case' 0 CA--C 1.503 -0.833 0 N-CA-C 109.416 -0.587 . . . . 0.0 109.416 -177.849 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -71.53 -41.81 68.71 Favored 'General case' 0 C--N 1.32 -0.71 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 -177.1 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.435 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -63.94 -48.61 75.83 Favored 'General case' 0 C--O 1.218 -0.57 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 176.407 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 71.4 mt -56.87 -43.88 81.66 Favored 'General case' 0 CA--C 1.514 -0.42 0 N-CA-C 112.445 0.535 . . . . 0.0 112.445 -176.715 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -65.35 -38.72 90.95 Favored 'General case' 0 C--N 1.322 -0.619 0 CA-C-O 121.322 0.582 . . . . 0.0 111.326 -179.658 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.415 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.24 -47.13 71.7 Favored 'General case' 0 C--N 1.322 -0.611 0 CA-C-O 121.425 0.631 . . . . 0.0 109.463 178.631 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.435 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -57.09 -42.2 80.27 Favored 'General case' 0 N--CA 1.431 -1.382 0 CA-C-N 115.274 -0.876 . . . . 0.0 111.054 178.085 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -62.8 -37.93 88.68 Favored 'General case' 0 C--N 1.323 -0.573 0 CA-C-N 119.094 0.861 . . . . 0.0 112.579 -177.942 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 5.6 tt0 -70.93 -44.09 66.87 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.909 -1.145 . . . . 0.0 107.909 177.91 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -56.86 -32.92 66.29 Favored 'General case' 0 C--N 1.325 -0.472 0 CA-C-O 121.522 0.677 . . . . 0.0 110.738 179.164 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.53 -16.97 66.13 Favored Glycine 0 C--O 1.239 0.433 0 CA-C-O 119.165 -0.797 . . . . 0.0 114.749 -179.84 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.5 t -113.74 -15.37 12.46 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 118.15 0.975 . . . . 0.0 111.227 -179.766 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.0 mt -64.94 145.24 56.58 Favored 'General case' 0 CA--C 1.535 0.387 0 O-C-N 121.98 -0.45 . . . . 0.0 110.813 179.734 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.426 ' O ' HD13 ' A' ' 512' ' ' ILE . 38.3 tt0 -79.62 84.29 5.49 Favored 'General case' 0 C--O 1.216 -0.676 0 CA-C-O 122.531 1.158 . . . . 0.0 109.653 178.168 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.954 HG21 HD22 ' A' ' 546' ' ' LEU . 27.0 m -96.44 48.18 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.315 0 CA-C-O 123.214 1.483 . . . . 0.0 108.21 -178.705 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.7 t -68.16 172.99 5.06 Favored 'General case' 0 C--N 1.314 -0.974 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 -178.296 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 14.6 m -49.29 -31.65 9.41 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 114.195 1.183 . . . . 0.0 114.195 -173.643 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.4 tt0 -55.43 -44.59 76.44 Favored 'General case' 0 C--N 1.325 -0.484 0 N-CA-C 111.759 0.281 . . . . 0.0 111.759 177.015 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.426 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.4 mp -88.66 -42.18 14.55 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.566 0 CA-C-O 121.72 0.772 . . . . 0.0 109.1 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.424 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -57.47 -40.5 78.71 Favored 'General case' 0 C--N 1.318 -0.802 0 N-CA-C 113.434 0.901 . . . . 0.0 113.434 -175.591 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 89.7 mt-30 -69.71 -31.3 69.23 Favored 'General case' 0 C--N 1.322 -0.59 0 CA-C-N 116.442 -0.345 . . . . 0.0 111.15 -177.455 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.9 ptmt -89.29 -5.14 57.81 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 121.007 -0.277 . . . . 0.0 111.233 178.31 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 13.6 m120 -128.94 45.03 2.86 Favored 'General case' 0 CA--C 1.539 0.55 0 CA-C-O 121.43 0.633 . . . . 0.0 112.19 -179.652 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 25.2 p -65.08 -26.76 68.37 Favored 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 -179.375 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 -63.39 -27.25 69.17 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-O 121.918 0.866 . . . . 0.0 111.992 177.799 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 55.0 t -70.65 -45.69 72.92 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 107.074 -1.454 . . . . 0.0 107.074 179.549 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 46.5 t -63.4 -36.99 78.35 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 179.052 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.4 -36.36 82.08 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 116.331 -0.395 . . . . 0.0 110.861 177.42 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 61.4 m -76.26 -40.54 51.63 Favored 'General case' 0 C--O 1.22 -0.479 0 CA-C-N 118.182 0.446 . . . . 0.0 110.457 179.445 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.717 HD23 HD11 ' A' ' 526' ' ' ILE . 61.4 mt -57.97 -35.12 70.71 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 121.051 0.453 . . . . 0.0 111.087 178.85 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 56.0 mtmt -63.86 -29.0 70.23 Favored 'General case' 0 N--CA 1.468 0.464 0 O-C-N 121.9 -0.5 . . . . 0.0 111.452 175.733 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 62.6 mttm -73.19 -46.46 50.4 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 120.787 0.327 . . . . 0.0 111.31 178.81 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.717 HD11 HD23 ' A' ' 523' ' ' LEU . 7.7 pt -77.12 -21.18 14.4 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 114.751 1.389 . . . . 0.0 114.751 -175.983 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.445 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.1 OUTLIER -63.28 -14.7 52.52 Favored 'General case' 0 C--O 1.213 -0.842 0 O-C-N 121.746 -0.596 . . . . 0.0 112.282 175.786 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 15.6 ptp180 -118.86 17.78 13.37 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 122.48 0.312 . . . . 0.0 111.233 175.69 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . 0.418 ' CE1' ' HB3' ' A' ' 531' ' ' ALA . 10.1 t80 -62.88 126.16 26.4 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-O 120.957 0.408 . . . . 0.0 110.856 -177.071 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 44.1 mmtm -92.43 -24.95 18.68 Favored 'General case' 0 C--O 1.217 -0.648 0 N-CA-C 115.518 1.673 . . . . 0.0 115.518 -176.437 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . 0.418 ' HB3' ' CE1' ' A' ' 529' ' ' TYR . . . -64.82 -39.81 94.19 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-O 121.155 0.502 . . . . 0.0 110.965 -176.963 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 33.5 m120 -133.64 121.09 21.51 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 116.125 -0.489 . . . . 0.0 110.055 -179.405 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 40.3 tptt -60.26 -44.02 95.65 Favored 'General case' 0 C--O 1.211 -0.963 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 177.875 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -55.69 -43.98 76.92 Favored 'General case' 0 C--N 1.317 -0.809 0 N-CA-C 113.05 0.759 . . . . 0.0 113.05 -175.401 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 70.6 t -58.39 -44.65 89.05 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.46 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 178.136 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 4.8 ttp -64.94 -43.29 93.22 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -179.106 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -63.43 -48.9 75.87 Favored 'General case' 0 C--N 1.323 -0.571 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 179.353 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 40.2 tptt -71.66 -37.72 70.76 Favored 'General case' 0 CA--C 1.514 -0.408 0 C-N-CA 118.493 -1.283 . . . . 0.0 111.19 -177.518 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . 0.425 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -58.2 -40.73 82.33 Favored 'General case' 0 C--O 1.214 -0.786 0 CA-C-O 121.785 0.802 . . . . 0.0 108.952 178.363 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.445 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -62.75 -50.81 69.6 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.219 -1.355 . . . . 0.0 113.84 178.756 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -58.47 -43.67 89.01 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 107.554 -1.276 . . . . 0.0 107.554 -179.381 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 52.9 t -67.21 -52.62 41.01 Favored 'Isoleucine or valine' 0 CA--C 1.506 -0.746 0 CA-C-N 115.962 -0.563 . . . . 0.0 110.949 -177.134 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 54.1 t80 -53.98 -44.05 70.48 Favored 'General case' 0 C--N 1.322 -0.593 0 C-N-CA 122.598 0.359 . . . . 0.0 110.551 -177.416 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 50.8 m -64.07 -38.52 91.37 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 123.844 0.858 . . . . 0.0 111.681 179.417 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 96.4 mtt180 -64.41 -28.5 69.72 Favored 'General case' 0 C--N 1.32 -0.697 0 O-C-N 121.552 -0.717 . . . . 0.0 110.781 176.734 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.954 HD22 HG21 ' A' ' 508' ' ' VAL . 7.2 mt -74.39 -35.62 63.49 Favored 'General case' 0 CA--C 1.506 -0.74 0 N-CA-C 107.595 -1.261 . . . . 0.0 107.595 -178.027 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 7.8 mmpt? -57.72 -39.48 77.37 Favored 'General case' 0 C--O 1.215 -0.744 0 CA-C-N 115.141 -0.936 . . . . 0.0 109.165 177.413 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 22.9 t -73.02 -17.23 61.47 Favored 'General case' 0 C--N 1.325 -0.477 0 N-CA-C 113.492 0.923 . . . . 0.0 113.492 178.947 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 73.1 mtt85 -98.62 -12.38 21.17 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 112.605 0.594 . . . . 0.0 112.605 -179.929 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -160.4 -87.89 0.07 OUTLIER Glycine 0 C--O 1.224 -0.477 0 C-N-CA 120.923 -0.656 . . . . 0.0 113.403 -177.18 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 44.8 t . . . . . 0 C--O 1.25 1.106 0 N-CA-C 105.178 -2.156 . . . . 0.0 105.178 -178.96 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.899 0 CA-C-O 118.564 -0.731 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -67.21 -36.62 82.09 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 107.591 -1.263 . . . . 0.0 107.591 175.975 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 19.8 m -91.85 149.33 38.82 Favored Pre-proline 0 C--O 1.243 0.759 0 N-CA-C 107.302 -1.37 . . . . 0.0 107.302 175.044 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 74.3 Cg_endo -68.44 147.56 71.45 Favored 'Trans proline' 0 C--O 1.237 0.432 0 C-N-CA 118.091 -0.806 . . . . 0.0 113.37 179.42 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 7.1 m -72.79 167.45 20.88 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-N 115.262 -0.881 . . . . 0.0 111.26 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 50.9 t -54.79 -45.83 74.31 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.746 0 O-C-N 121.894 -0.504 . . . . 0.0 111.578 179.516 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.417 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.9 OUTLIER -62.48 -31.58 72.34 Favored 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 116.036 -0.529 . . . . 0.0 112.021 -178.854 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -73.5 -42.14 62.2 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-O 122.138 0.97 . . . . 0.0 108.405 179.384 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.1 mtpt -70.33 -32.71 70.56 Favored 'General case' 0 CA--C 1.508 -0.672 0 CA-C-N 115.117 -0.947 . . . . 0.0 110.379 -177.628 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.415 ' C ' HD13 ' A' ' 475' ' ' LEU . 1.9 tm? -55.05 -40.21 70.04 Favored 'General case' 0 C--N 1.321 -0.645 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.358 178.842 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -54.23 -40.6 67.85 Favored 'General case' 0 C--N 1.325 -0.46 0 C-N-CA 120.422 -0.511 . . . . 0.0 110.686 -178.268 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -69.54 -53.2 20.14 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 120.733 -0.387 . . . . 0.0 111.314 177.75 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.79 -46.86 86.56 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.096 0.776 . . . . 0.0 113.096 -178.742 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.0 t-160 -60.25 -43.67 95.91 Favored 'General case' 0 C--O 1.216 -0.7 0 N-CA-C 108.379 -0.971 . . . . 0.0 108.379 -179.465 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 69.0 m -60.24 -38.71 84.28 Favored 'General case' 0 C--O 1.221 -0.432 0 CA-C-N 118.01 0.368 . . . . 0.0 111.124 -179.83 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -65.71 -36.34 83.34 Favored 'General case' 0 CA--C 1.505 -0.78 0 C-N-CA 120.159 -0.617 . . . . 0.0 110.978 177.549 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 89.1 mt -61.46 -43.12 96.25 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.997 0 N-CA-C 106.184 -1.784 . . . . 0.0 106.184 178.696 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 30.6 mmmt -62.18 -45.87 91.48 Favored 'General case' 0 N--CA 1.476 0.86 0 N-CA-C 112.263 0.468 . . . . 0.0 112.263 179.825 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 20.0 m-85 -66.5 -34.23 77.45 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 120.747 0.308 . . . . 0.0 111.207 -178.368 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -64.35 -18.95 65.13 Favored 'General case' 0 C--N 1.321 -0.638 0 N-CA-C 112.804 0.668 . . . . 0.0 112.804 179.677 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 33.8 mt -108.2 12.15 26.86 Favored 'General case' 0 C--N 1.324 -0.512 0 N-CA-C 112.353 0.501 . . . . 0.0 112.353 -176.573 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 8.5 mttm -56.82 131.6 49.87 Favored 'General case' 0 CA--C 1.498 -1.044 0 N-CA-C 108.023 -1.103 . . . . 0.0 108.023 176.869 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 14.5 m -72.7 -20.39 19.3 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.894 0 CA-C-N 114.797 -1.092 . . . . 0.0 110.634 -179.329 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -79.7 -30.74 41.13 Favored 'General case' 0 N--CA 1.435 -1.21 0 CA-C-N 113.779 -1.555 . . . . 0.0 110.921 -178.951 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 25.0 t -166.27 85.8 0.92 Allowed Pre-proline 0 C--O 1.239 0.512 0 CA-C-N 115.789 -0.642 . . . . 0.0 110.418 -177.977 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -72.81 149.56 48.21 Favored 'Trans proline' 0 CA--C 1.534 0.503 0 C-N-CA 117.314 -1.324 . . . . 0.0 112.415 178.477 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.4 t0 -137.29 93.39 2.81 Favored 'General case' 0 C--N 1.324 -0.531 0 CA-C-O 121.589 0.709 . . . . 0.0 110.183 -177.246 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.417 HG12 ' H ' ' A' ' 493' ' ' VAL . 0.8 OUTLIER -58.4 -47.34 88.25 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.733 0 N-CA-C 113.853 1.057 . . . . 0.0 113.853 -177.438 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 26.5 pttt -58.77 -31.4 68.34 Favored 'General case' 0 CA--C 1.503 -0.865 0 CA-C-O 121.696 0.76 . . . . 0.0 110.347 -176.38 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 60.0 ttm-85 -68.81 -43.33 75.81 Favored 'General case' 0 C--N 1.316 -0.873 0 CA-C-N 114.662 -1.154 . . . . 0.0 109.227 -178.673 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.438 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -63.24 -48.81 76.68 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 108.326 -0.99 . . . . 0.0 108.326 176.556 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.9 mt -57.48 -42.79 83.34 Favored 'General case' 0 N--CA 1.473 0.709 0 N-CA-C 111.989 0.366 . . . . 0.0 111.989 -176.762 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -65.53 -38.58 90.07 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-O 121.54 0.686 . . . . 0.0 111.495 179.163 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . . . . . . . . . . . -67.69 -47.07 70.48 Favored 'General case' 0 C--N 1.321 -0.632 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 178.034 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.438 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.88 -45.58 82.46 Favored 'General case' 0 N--CA 1.434 -1.244 0 CA-C-N 115.293 -0.867 . . . . 0.0 111.206 178.859 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 6.4 pt-20 -64.75 -34.63 78.78 Favored 'General case' 0 C--N 1.322 -0.596 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -176.486 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.06 -44.11 66.42 Favored 'General case' 0 N--CA 1.467 0.401 0 N-CA-C 107.327 -1.361 . . . . 0.0 107.327 176.282 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -55.79 -35.6 66.47 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-O 121.28 0.562 . . . . 0.0 110.898 179.429 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -67.46 -18.65 69.97 Favored Glycine 0 C--O 1.239 0.448 0 N-CA-C 114.762 0.665 . . . . 0.0 114.762 -179.858 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 12.7 t -109.31 -12.4 14.76 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 117.917 0.858 . . . . 0.0 110.581 -179.414 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.6 mt -68.78 146.25 53.07 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 109.764 -0.458 . . . . 0.0 109.764 179.163 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 29.4 tt0 -80.35 80.58 6.76 Favored 'General case' 0 C--O 1.216 -0.671 0 CA-C-O 122.508 1.147 . . . . 0.0 109.031 178.144 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.881 HG21 HD22 ' A' ' 546' ' ' LEU . 29.3 m -94.3 48.17 0.1 OUTLIER 'Isoleucine or valine' 0 C--N 1.309 -1.162 0 CA-C-O 123.071 1.415 . . . . 0.0 107.576 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.5 t -66.68 173.62 3.35 Favored 'General case' 0 C--N 1.317 -0.823 0 CA-C-N 114.121 -1.4 . . . . 0.0 107.709 -177.978 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 34.3 m -48.46 -35.33 12.73 Favored 'General case' 0 N--CA 1.468 0.446 0 N-CA-C 113.706 1.002 . . . . 0.0 113.706 -173.517 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 51.1 tt0 -55.52 -44.34 76.58 Favored 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 112.628 0.603 . . . . 0.0 112.628 177.267 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.2 mp -87.62 -38.71 12.25 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.397 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -179.41 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.418 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -60.21 -37.74 81.2 Favored 'General case' 0 C--N 1.318 -0.776 0 N-CA-C 113.004 0.742 . . . . 0.0 113.004 -176.749 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 70.7 mt-30 -66.27 -33.73 76.4 Favored 'General case' 0 C--N 1.324 -0.534 0 CA-C-O 120.567 0.222 . . . . 0.0 111.426 -179.553 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -89.35 -3.29 58.52 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 121.076 -0.25 . . . . 0.0 111.316 179.172 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 40.1 m-80 -128.12 43.42 3.14 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 121.875 0.845 . . . . 0.0 112.398 179.802 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -64.17 -28.56 69.84 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 121.722 -0.611 . . . . 0.0 112.466 179.482 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -70.53 -24.26 62.78 Favored 'General case' 0 N--CA 1.471 0.581 0 CA-C-O 121.501 0.667 . . . . 0.0 112.034 179.176 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 86.7 t -70.87 -43.82 76.58 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.694 0 N-CA-C 106.152 -1.796 . . . . 0.0 106.152 177.302 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 49.5 t -62.53 -35.62 70.95 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.428 0 N-CA-C 107.962 -1.125 . . . . 0.0 107.962 178.244 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.99 -35.93 81.85 Favored 'General case' 0 C--N 1.325 -0.492 0 CA-C-O 119.042 -0.504 . . . . 0.0 111.645 177.318 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.5 m -77.06 -39.17 50.87 Favored 'General case' 0 C--O 1.219 -0.527 0 CA-C-N 119.165 0.893 . . . . 0.0 108.734 179.32 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.545 HD23 HD11 ' A' ' 526' ' ' ILE . 34.9 mt -57.5 -35.01 69.69 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-O 120.813 0.34 . . . . 0.0 111.664 179.019 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.5 mtmt -63.3 -29.12 70.5 Favored 'General case' 0 N--CA 1.471 0.606 0 O-C-N 121.878 -0.513 . . . . 0.0 111.392 175.623 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 82.1 mttt -76.49 -46.24 27.6 Favored 'General case' 0 N--CA 1.469 0.501 0 CA-C-O 120.657 0.265 . . . . 0.0 111.708 -179.422 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.545 HD11 HD23 ' A' ' 523' ' ' LEU . 1.1 pt -74.77 -23.57 17.78 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.932 0 N-CA-C 114.019 1.118 . . . . 0.0 114.019 -176.929 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.455 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 1.7 mtm180 -59.94 -20.65 58.67 Favored 'General case' 0 C--O 1.214 -0.788 0 N-CA-C 112.243 0.46 . . . . 0.0 112.243 176.152 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 14.2 ptm180 -119.51 19.41 12.66 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 122.976 0.51 . . . . 0.0 111.48 178.854 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -62.03 117.91 6.59 Favored 'General case' 0 C--O 1.221 -0.424 0 CA-C-O 121.063 0.458 . . . . 0.0 111.355 -177.564 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 96.2 mttt -79.49 -26.59 41.59 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 115.481 1.66 . . . . 0.0 115.481 -176.475 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -67.14 -40.93 86.84 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.692 -0.403 . . . . 0.0 112.081 -175.354 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 34.3 m120 -131.55 117.0 18.16 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 110.104 -0.332 . . . . 0.0 110.104 -178.464 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 38.0 tptt -59.05 -43.62 91.7 Favored 'General case' 0 C--O 1.211 -0.932 0 CA-C-N 116.23 -0.441 . . . . 0.0 110.617 179.039 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.8 t0 -57.79 -42.24 83.76 Favored 'General case' 0 C--O 1.219 -0.536 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -177.062 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 73.6 t -57.53 -43.12 82.45 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 O-C-N 121.809 -0.557 . . . . 0.0 109.542 177.454 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -64.84 -43.03 94.36 Favored 'General case' 0 C--N 1.325 -0.473 0 N-CA-C 110.073 -0.343 . . . . 0.0 110.073 178.559 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -63.87 -49.28 73.39 Favored 'General case' 0 C--N 1.322 -0.609 0 O-C-N 123.121 0.263 . . . . 0.0 110.476 -178.336 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -70.88 -40.63 72.13 Favored 'General case' 0 C--O 1.222 -0.369 0 C-N-CA 119.94 -0.704 . . . . 0.0 111.958 -178.222 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.14 -38.77 80.47 Favored 'General case' 0 C--O 1.214 -0.798 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.14 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.455 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -63.79 -50.17 70.05 Favored 'General case' 0 C--N 1.314 -0.94 0 N-CA-C 114.174 1.175 . . . . 0.0 114.174 177.757 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -57.68 -42.15 83.02 Favored 'General case' 0 C--N 1.324 -0.519 0 N-CA-C 107.935 -1.135 . . . . 0.0 107.935 -179.947 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 77.0 t -70.44 -52.06 32.59 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.859 0 CA-C-N 115.611 -0.722 . . . . 0.0 112.135 -178.618 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 38.9 t80 -54.48 -44.47 72.65 Favored 'General case' 0 C--N 1.322 -0.596 0 CA-C-O 120.641 0.258 . . . . 0.0 110.412 -177.171 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 24.8 m -65.25 -38.43 90.33 Favored 'General case' 0 C--N 1.322 -0.587 0 C-N-CA 122.909 0.483 . . . . 0.0 111.022 179.358 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 44.1 mtt180 -59.99 -30.71 69.31 Favored 'General case' 0 C--O 1.217 -0.619 0 O-C-N 121.838 -0.539 . . . . 0.0 110.752 176.573 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.881 HD22 HG21 ' A' ' 508' ' ' VAL . 3.8 mt -76.24 -30.88 58.08 Favored 'General case' 0 CA--C 1.502 -0.885 0 N-CA-C 108.064 -1.088 . . . . 0.0 108.064 -176.782 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -63.11 -37.95 89.23 Favored 'General case' 0 C--O 1.214 -0.779 0 CA-C-N 115.317 -0.856 . . . . 0.0 108.899 177.575 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 15.7 m -76.81 -15.03 59.84 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.825 1.046 . . . . 0.0 113.825 177.982 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.6 mtt-85 -96.92 -11.09 25.13 Favored 'General case' 0 N--CA 1.474 0.764 0 O-C-N 122.154 -0.341 . . . . 0.0 110.811 178.358 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -105.58 -176.2 24.05 Favored Glycine 0 N--CA 1.451 -0.323 0 N-CA-C 111.123 -0.791 . . . . 0.0 111.123 -177.04 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.257 1.473 0 CA-C-O 116.158 -1.877 . . . . 0.0 108.325 -177.038 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.675 0 N-CA-C 109.716 -0.476 . . . . 0.0 109.716 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -71.84 154.08 41.5 Favored 'General case' 0 C--N 1.326 -0.43 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 177.113 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 25.1 m -73.31 144.99 84.96 Favored Pre-proline 0 C--N 1.323 -0.581 0 N-CA-C 109.527 -0.546 . . . . 0.0 109.527 178.278 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -70.07 165.66 30.59 Favored 'Trans proline' 0 CA--C 1.533 0.459 0 C-N-CA 118.419 -0.587 . . . . 0.0 112.491 177.717 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 15.0 m -60.92 159.73 10.88 Favored 'General case' 0 C--O 1.222 -0.389 0 N-CA-C 113.677 0.991 . . . . 0.0 113.677 -178.029 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 22.4 t -53.0 -47.04 54.47 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.122 0 N-CA-C 111.948 0.351 . . . . 0.0 111.948 178.841 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.424 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 0.1 OUTLIER -63.74 -34.19 77.33 Favored 'General case' 0 C--N 1.316 -0.87 0 CA-C-N 116.532 -0.304 . . . . 0.0 111.585 -177.252 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 15.6 mm-40 -68.76 -40.5 79.71 Favored 'General case' 0 CA--C 1.505 -0.777 0 CA-C-O 122.464 1.126 . . . . 0.0 108.526 179.42 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 58.5 mtpt -73.34 -34.86 65.88 Favored 'General case' 0 C--N 1.319 -0.76 0 CA-C-N 114.729 -1.123 . . . . 0.0 110.1 -177.731 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.571 HD21 HG21 ' A' ' 519' ' ' VAL . 4.5 tt -58.42 -36.14 73.16 Favored 'General case' 0 C--N 1.319 -0.729 0 CA-C-N 114.785 -1.098 . . . . 0.0 109.054 179.408 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 67.3 mt-30 -54.18 -43.13 70.43 Favored 'General case' 0 N--CA 1.465 0.318 0 CA-C-N 118.456 0.571 . . . . 0.0 109.862 178.325 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -67.82 -56.32 9.6 Favored 'General case' 0 C--O 1.217 -0.655 0 C-N-CA 120.699 -0.4 . . . . 0.0 110.556 178.372 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -56.48 -44.99 81.16 Favored 'General case' 0 C--O 1.217 -0.624 0 N-CA-C 113.1 0.778 . . . . 0.0 113.1 -177.333 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . 0.441 ' CG ' HG22 ' A' ' 519' ' ' VAL . 14.4 t-160 -58.52 -43.56 89.21 Favored 'General case' 0 C--N 1.319 -0.731 0 N-CA-C 109.33 -0.618 . . . . 0.0 109.33 179.166 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 49.5 m -64.74 -37.85 88.99 Favored 'General case' 0 C--N 1.328 -0.349 0 N-CA-C 111.669 0.248 . . . . 0.0 111.669 179.495 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.465 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.8 mm-40 -63.38 -38.14 90.01 Favored 'General case' 0 CA--C 1.506 -0.729 0 C-N-CA 120.648 -0.421 . . . . 0.0 110.05 178.307 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.5 mt -58.11 -44.25 87.03 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.979 0 N-CA-C 107.336 -1.357 . . . . 0.0 107.336 178.535 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 28.4 mmtt -62.52 -46.3 89.04 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 112.23 0.456 . . . . 0.0 112.23 -179.514 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 25.4 m-85 -64.6 -33.59 76.28 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 120.871 0.367 . . . . 0.0 111.159 -178.243 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.84 -18.21 65.18 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 112.45 0.537 . . . . 0.0 112.45 179.371 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . 0.409 HD11 ' CG2' ' A' ' 526' ' ' ILE . 26.1 mt -108.07 12.15 27.08 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 112.144 0.424 . . . . 0.0 112.144 -178.112 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 8.8 mtpt -56.12 127.81 32.43 Favored 'General case' 0 CA--C 1.493 -1.219 0 N-CA-C 106.755 -1.572 . . . . 0.0 106.755 176.527 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 29.6 m -70.25 -20.48 22.87 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.973 0 CA-C-N 115.17 -0.923 . . . . 0.0 109.211 178.536 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -80.97 -27.41 36.0 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 114.155 -1.384 . . . . 0.0 111.091 177.864 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 4.2 m -160.81 75.62 2.63 Favored Pre-proline 0 N--CA 1.473 0.676 0 N-CA-C 112.214 0.45 . . . . 0.0 112.214 -176.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 97.7 Cg_endo -74.35 143.35 31.31 Favored 'Trans proline' 0 C--N 1.343 0.285 0 C-N-CA 113.523 -3.851 . . . . 0.0 112.118 -179.947 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -137.25 98.19 3.67 Favored 'General case' 0 C--N 1.323 -0.551 0 CA-C-O 121.788 0.804 . . . . 0.0 109.734 -178.65 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -59.44 -45.51 93.56 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.859 0 N-CA-C 112.591 0.589 . . . . 0.0 112.591 -178.509 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 62.4 mttm -59.55 -31.05 69.06 Favored 'General case' 0 CA--C 1.507 -0.692 0 N-CA-C 109.929 -0.397 . . . . 0.0 109.929 -178.362 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 67.7 ttt180 -70.37 -41.29 73.3 Favored 'General case' 0 C--N 1.323 -0.586 0 C-N-CA 119.762 -0.775 . . . . 0.0 108.96 -178.1 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.48 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.03 -48.35 76.66 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 175.889 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 96.7 mt -57.27 -43.18 82.87 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 112.024 0.379 . . . . 0.0 112.024 -176.719 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 14.0 t-20 -64.58 -39.03 93.0 Favored 'General case' 0 C--N 1.322 -0.612 0 CA-C-O 121.532 0.682 . . . . 0.0 111.3 178.677 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.465 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -65.74 -48.5 71.68 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-O 121.648 0.737 . . . . 0.0 109.695 178.599 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.48 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.1 OUTLIER -57.86 -48.27 80.3 Favored 'General case' 0 N--CA 1.43 -1.427 0 CA-C-N 115.198 -0.91 . . . . 0.0 110.997 178.641 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 5.6 pt-20 -62.94 -33.07 74.57 Favored 'General case' 0 C--N 1.322 -0.607 0 C-N-CA 119.847 -0.741 . . . . 0.0 112.803 -175.631 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -72.35 -48.65 40.18 Favored 'General case' 0 C--O 1.217 -0.645 0 N-CA-C 107.098 -1.445 . . . . 0.0 107.098 175.44 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.48 -30.67 42.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.801 0.81 . . . . 0.0 110.155 -178.849 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -63.85 -23.6 67.57 Favored Glycine 0 N--CA 1.449 -0.453 0 N-CA-C 115.846 1.098 . . . . 0.0 115.846 176.821 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 9.0 t -104.88 -26.48 12.2 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 117.883 0.841 . . . . 0.0 110.367 178.766 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.2 mp -57.0 140.5 48.82 Favored 'General case' 0 N--CA 1.449 -0.491 0 N-CA-C 112.983 0.734 . . . . 0.0 112.983 176.058 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -76.99 84.41 3.51 Favored 'General case' 0 C--O 1.221 -0.406 0 CA-C-O 122.339 1.066 . . . . 0.0 110.692 -178.914 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.585 ' CG2' HD22 ' A' ' 546' ' ' LEU . 16.6 m -103.42 68.95 0.29 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.302 0 CA-C-O 126.794 3.188 . . . . 0.0 105.489 178.039 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 9.0 t -80.41 173.73 12.31 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-N 109.892 -3.322 . . . . 0.0 105.204 172.636 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 1.2 m -49.36 -36.73 22.4 Favored 'General case' 0 C--O 1.22 -0.484 0 N-CA-C 113.875 1.065 . . . . 0.0 113.875 -175.365 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 46.5 tt0 -54.29 -43.77 71.35 Favored 'General case' 0 C--N 1.325 -0.487 0 N-CA-C 112.831 0.678 . . . . 0.0 112.831 -179.017 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . . . . . . . . . 4.0 mp -88.56 -38.98 12.24 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.801 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 -178.03 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . . . . . . . . . 4.8 mt -61.61 -39.4 91.12 Favored 'General case' 0 N--CA 1.438 -1.051 0 N-CA-C 114.334 1.235 . . . . 0.0 114.334 -175.886 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 71.5 mt-30 -68.82 -31.0 69.67 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 121.193 -0.203 . . . . 0.0 110.644 -177.861 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -87.27 -7.04 58.28 Favored 'General case' 0 C--O 1.219 -0.514 0 C-N-CA 121.122 -0.231 . . . . 0.0 111.073 176.781 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 54.9 m-80 -129.6 45.77 2.75 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-O 121.545 0.688 . . . . 0.0 112.11 179.194 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 16.2 p -63.89 -25.95 68.39 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 112.806 0.669 . . . . 0.0 112.806 -178.877 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.07 -29.03 69.3 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-O 121.846 0.831 . . . . 0.0 112.337 178.556 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . 0.571 HG21 HD21 ' A' ' 475' ' ' LEU . 65.0 t -71.08 -45.01 74.27 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.799 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 178.553 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 57.2 t -61.0 -38.1 78.73 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.52 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 178.149 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -64.25 -38.95 92.87 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-N 116.332 -0.395 . . . . 0.0 110.88 177.612 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 95.3 m -71.94 -38.69 69.79 Favored 'General case' 0 C--O 1.219 -0.513 0 CA-C-N 118.371 0.532 . . . . 0.0 109.961 -178.613 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.634 HD23 HD11 ' A' ' 526' ' ' ILE . 63.3 mt -58.63 -34.89 71.69 Favored 'General case' 0 C--N 1.321 -0.66 0 CA-C-O 121.116 0.484 . . . . 0.0 111.461 179.422 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 58.9 mtmt -67.26 -29.13 68.67 Favored 'General case' 0 C--N 1.323 -0.552 0 O-C-N 121.613 -0.679 . . . . 0.0 111.012 176.27 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 86.5 mttt -71.52 -42.1 68.37 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-O 120.725 0.298 . . . . 0.0 111.151 179.861 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.634 HD11 HD23 ' A' ' 523' ' ' LEU . 6.0 pt -78.65 -23.28 13.12 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.772 0 N-CA-C 113.355 0.872 . . . . 0.0 113.355 -178.266 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.539 ' HD2' ' HA ' ' A' ' 540' ' ' ALA . 7.4 mtp180 -64.69 -13.31 53.84 Favored 'General case' 0 C--O 1.217 -0.638 0 N-CA-C 113.012 0.745 . . . . 0.0 113.012 175.655 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.89 18.47 13.25 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 122.947 0.499 . . . . 0.0 111.544 175.07 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 18.7 t80 -66.47 118.07 9.57 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-O 120.995 0.426 . . . . 0.0 112.044 -177.677 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -81.81 -26.64 34.18 Favored 'General case' 0 N--CA 1.472 0.639 0 N-CA-C 115.716 1.747 . . . . 0.0 115.716 -177.573 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -68.54 -29.87 68.54 Favored 'General case' 0 C--O 1.219 -0.512 0 N-CA-C 112.778 0.658 . . . . 0.0 112.778 -175.151 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 5.9 m-80 -144.69 118.88 9.48 Favored 'General case' 0 C--N 1.325 -0.488 0 N-CA-C 109.856 -0.424 . . . . 0.0 109.856 -179.415 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 33.3 tptt -61.76 -46.58 88.95 Favored 'General case' 0 C--O 1.213 -0.86 0 CA-C-N 115.953 -0.567 . . . . 0.0 111.452 -178.626 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -56.04 -38.96 71.28 Favored 'General case' 0 C--N 1.324 -0.518 0 CA-C-O 121.17 0.509 . . . . 0.0 112.109 -175.175 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 77.8 t -55.96 -45.31 80.07 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.675 0 O-C-N 122.076 -0.39 . . . . 0.0 110.111 177.539 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 1.8 ttp -68.06 -40.78 82.69 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-O 118.424 -0.798 . . . . 0.0 109.754 178.432 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -63.09 -47.98 80.55 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 119.303 0.956 . . . . 0.0 111.567 179.552 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 35.7 tptt -72.18 -37.91 69.21 Favored 'General case' 0 CA--C 1.514 -0.441 0 C-N-CA 119.076 -1.049 . . . . 0.0 111.378 -178.741 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . 0.412 ' HB2' HD12 ' A' ' 526' ' ' ILE . . . -59.08 -38.06 78.56 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 178.254 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.539 ' HA ' ' HD2' ' A' ' 527' ' ' ARG . . . -66.63 -49.97 64.52 Favored 'General case' 0 C--N 1.311 -1.067 0 CA-C-N 114.888 -1.051 . . . . 0.0 113.358 179.275 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.66 -42.48 83.59 Favored 'General case' 0 C--N 1.323 -0.548 0 N-CA-C 107.373 -1.343 . . . . 0.0 107.373 179.886 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 75.3 t -70.59 -53.45 22.37 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.262 0 CA-C-N 116.292 -0.413 . . . . 0.0 111.965 -177.887 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 69.9 t80 -53.81 -46.97 71.26 Favored 'General case' 0 C--N 1.321 -0.667 0 CA-C-O 121.184 0.516 . . . . 0.0 110.312 -176.011 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 27.8 m -60.07 -38.15 82.01 Favored 'General case' 0 C--N 1.318 -0.773 0 C-N-CA 123.38 0.672 . . . . 0.0 112.343 178.286 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -65.21 -27.41 68.66 Favored 'General case' 0 C--N 1.32 -0.709 0 O-C-N 121.419 -0.801 . . . . 0.0 111.785 176.749 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.585 HD22 ' CG2' ' A' ' 508' ' ' VAL . 9.7 mt -75.59 -35.77 60.49 Favored 'General case' 0 CA--C 1.498 -1.037 0 N-CA-C 106.562 -1.644 . . . . 0.0 106.562 -174.651 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.64 -33.95 73.55 Favored 'General case' 0 C--O 1.205 -1.273 0 CA-C-N 113.693 -1.594 . . . . 0.0 110.67 176.704 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 45.3 t -68.89 -43.46 75.22 Favored 'General case' 0 C--N 1.319 -0.72 0 C-N-CA 120.809 -0.357 . . . . 0.0 110.315 175.019 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 80.8 mtt85 -72.09 -28.42 63.29 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 115.665 1.728 . . . . 0.0 115.665 -178.469 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -118.99 8.63 12.5 Favored Glycine 0 C--N 1.323 -0.168 0 CA-C-O 118.815 -0.992 . . . . 0.0 115.411 -175.676 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 24.1 m . . . . . 0 C--O 1.244 0.772 0 O-C-N 124.555 0.797 . . . . 0.0 110.378 -175.513 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.614 0 N-CA-C 109.847 -0.427 . . . . 0.0 109.847 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -66.53 147.6 53.05 Favored 'General case' 0 C--N 1.326 -0.422 0 N-CA-C 107.774 -1.195 . . . . 0.0 107.774 177.756 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 40.6 m -126.38 71.59 71.63 Favored Pre-proline 0 C--N 1.325 -0.492 0 O-C-N 123.187 0.305 . . . . 0.0 110.296 178.859 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_endo -69.95 153.84 67.62 Favored 'Trans proline' 0 C--O 1.238 0.483 0 N-CA-C 114.213 0.813 . . . . 0.0 114.213 -178.185 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 13.1 m -67.7 162.76 23.02 Favored 'General case' 0 C--N 1.324 -0.502 0 CA-C-N 115.415 -0.811 . . . . 0.0 112.073 -179.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 45.6 t -54.21 -44.19 63.64 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.948 0 N-CA-C 112.153 0.427 . . . . 0.0 112.153 179.38 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -66.92 -33.18 75.02 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-O 120.762 0.315 . . . . 0.0 111.721 -178.274 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 48.1 mt-10 -68.18 -39.98 82.38 Favored 'General case' 0 C--N 1.324 -0.513 0 N-CA-C 107.555 -1.276 . . . . 0.0 107.555 177.675 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.3 mtpt -73.72 -32.18 63.76 Favored 'General case' 0 CA--C 1.509 -0.6 0 CA-C-N 114.837 -1.074 . . . . 0.0 110.935 -177.242 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.426 HD23 HD21 ' A' ' 503' ' ' LEU . 1.6 tm? -54.58 -38.96 67.33 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.361 -0.836 . . . . 0.0 109.253 178.833 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 5.5 mm-40 -53.18 -38.71 63.06 Favored 'General case' 0 C--N 1.324 -0.54 0 C-N-CA 121.321 -0.151 . . . . 0.0 111.264 -178.693 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -67.83 -57.67 5.89 Favored 'General case' 0 N--CA 1.468 0.432 0 N-CA-C 109.885 -0.413 . . . . 0.0 109.885 176.568 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -59.88 -46.22 90.0 Favored 'General case' 0 CA--C 1.505 -0.767 0 N-CA-C 113.304 0.853 . . . . 0.0 113.304 -174.526 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 14.8 t-160 -58.92 -43.16 91.08 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 108.83 -0.804 . . . . 0.0 108.83 -179.501 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 67.0 m -63.28 -40.4 97.28 Favored 'General case' 0 N--CA 1.464 0.232 0 CA-C-N 117.869 0.304 . . . . 0.0 111.213 -178.935 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.466 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 11.9 mm-40 -63.57 -37.52 87.65 Favored 'General case' 0 CA--C 1.508 -0.671 0 C-N-CA 120.671 -0.411 . . . . 0.0 111.149 178.862 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 94.3 mt -59.9 -44.06 93.52 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.989 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.168 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 49.2 mmtt -62.67 -44.67 95.66 Favored 'General case' 0 N--CA 1.478 0.942 0 O-C-N 122.153 -0.342 . . . . 0.0 111.919 -179.746 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -65.13 -33.88 77.06 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-O 120.781 0.324 . . . . 0.0 111.073 -178.189 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -66.89 -16.55 64.39 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 112.498 0.555 . . . . 0.0 112.498 179.249 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . . . . . . . . . 38.4 mt -111.08 12.24 21.98 Favored 'General case' 0 C--N 1.324 -0.539 0 CA-C-N 116.28 -0.418 . . . . 0.0 111.868 -177.459 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 10.2 mtpt -55.44 129.4 38.56 Favored 'General case' 0 C--O 1.21 -1.011 0 N-CA-C 106.538 -1.653 . . . . 0.0 106.538 176.665 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 54.9 t -62.62 -39.75 85.79 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.731 0 CA-C-O 122.16 0.981 . . . . 0.0 108.446 178.507 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -71.12 -28.07 64.04 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.066 -1.425 . . . . 0.0 113.414 -178.021 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.1 t -159.48 76.38 3.06 Favored Pre-proline 0 C--N 1.324 -0.54 0 N-CA-C 113.49 0.922 . . . . 0.0 113.49 -177.593 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 90.1 Cg_endo -75.33 146.6 31.68 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 117.495 -1.203 . . . . 0.0 113.812 179.516 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 65.8 t0 -137.37 101.64 4.57 Favored 'General case' 0 N--CA 1.47 0.526 0 CA-C-O 121.31 0.576 . . . . 0.0 111.397 178.575 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . 0.447 ' H ' HG12 ' A' ' 493' ' ' VAL . 0.3 OUTLIER -56.58 -46.17 82.54 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.692 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -179.429 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 15.0 pttt -58.77 -32.2 69.06 Favored 'General case' 0 CA--C 1.501 -0.925 0 CA-C-O 121.857 0.837 . . . . 0.0 109.791 -176.478 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 64.1 ttt180 -70.83 -40.48 72.41 Favored 'General case' 0 C--N 1.317 -0.836 0 CA-C-N 114.391 -1.277 . . . . 0.0 108.888 -176.476 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.437 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -65.51 -49.7 68.02 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 175.624 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 78.6 mt -56.91 -43.1 81.04 Favored 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 112.045 0.387 . . . . 0.0 112.045 -176.256 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 12.2 t-20 -66.01 -37.08 84.99 Favored 'General case' 0 C--N 1.324 -0.543 0 CA-C-O 121.467 0.651 . . . . 0.0 111.625 179.997 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.466 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -67.84 -47.71 68.21 Favored 'General case' 0 C--N 1.321 -0.632 0 CA-C-O 121.772 0.796 . . . . 0.0 109.316 177.702 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.437 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -56.71 -44.97 82.07 Favored 'General case' 0 N--CA 1.431 -1.4 0 CA-C-N 114.811 -1.086 . . . . 0.0 110.77 178.632 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 3.0 pt-20 -60.57 -36.8 79.37 Favored 'General case' 0 C--N 1.325 -0.46 0 CA-C-N 119.036 0.835 . . . . 0.0 112.673 -177.165 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 4.4 tt0 -73.77 -42.64 60.74 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 108.537 -0.912 . . . . 0.0 108.537 178.69 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.426 HD21 HD23 ' A' ' 475' ' ' LEU . 0.5 OUTLIER -58.91 -34.29 71.52 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.164 0.507 . . . . 0.0 110.637 -179.436 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -66.1 -17.67 66.0 Favored Glycine 0 C--O 1.241 0.565 0 N-CA-C 114.848 0.699 . . . . 0.0 114.848 179.885 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.8 t -110.69 -14.7 13.99 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 117.699 0.75 . . . . 0.0 110.587 -179.131 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 1.2 mt -67.44 145.86 54.58 Favored 'General case' 0 C--N 1.328 -0.367 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 179.489 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.456 ' O ' HD13 ' A' ' 512' ' ' ILE . 30.3 tt0 -79.16 84.3 5.14 Favored 'General case' 0 C--O 1.216 -0.694 0 CA-C-O 122.53 1.157 . . . . 0.0 109.797 178.37 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.947 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -96.8 48.5 0.11 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.314 0 CA-C-O 123.351 1.548 . . . . 0.0 108.126 -178.966 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 12.5 t -67.26 174.43 3.25 Favored 'General case' 0 C--N 1.314 -0.939 0 N-CA-C 106.922 -1.511 . . . . 0.0 106.922 -179.436 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 13.1 m -49.23 -34.75 15.65 Favored 'General case' 0 C--O 1.216 -0.702 0 N-CA-C 113.502 0.927 . . . . 0.0 113.502 -173.361 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -53.7 -44.06 69.47 Favored 'General case' 0 C--N 1.324 -0.521 0 N-CA-C 111.73 0.271 . . . . 0.0 111.73 178.187 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.456 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.5 mp -88.48 -40.69 13.65 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.529 0 N-CA-C 109.574 -0.528 . . . . 0.0 109.574 179.53 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.464 HD12 ' HB2' ' A' ' 551' ' ' SER . 0.0 OUTLIER -59.82 -38.04 80.89 Favored 'General case' 0 C--N 1.32 -0.711 0 N-CA-C 112.878 0.696 . . . . 0.0 112.878 -175.644 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -66.99 -32.61 73.96 Favored 'General case' 0 C--N 1.322 -0.601 0 CA-C-N 116.405 -0.361 . . . . 0.0 111.559 -179.002 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -90.23 -4.3 57.29 Favored 'General case' 0 N--CA 1.47 0.568 0 O-C-N 122.347 -0.221 . . . . 0.0 111.088 178.813 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 41.2 m-80 -128.58 45.91 2.69 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-O 121.777 0.799 . . . . 0.0 112.484 -179.355 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 29.0 p -66.06 -26.91 67.71 Favored 'General case' 0 C--N 1.32 -0.679 0 O-C-N 121.426 -0.796 . . . . 0.0 112.399 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -68.4 -28.26 66.93 Favored 'General case' 0 N--CA 1.475 0.806 0 CA-C-O 122.596 1.189 . . . . 0.0 112.465 178.383 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 91.4 t -68.69 -44.78 82.14 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.848 0 N-CA-C 106.411 -1.7 . . . . 0.0 106.411 178.968 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.79 -37.5 79.87 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.509 0 N-CA-C 108.304 -0.998 . . . . 0.0 108.304 178.354 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -62.42 -34.32 76.54 Favored 'General case' 0 C--N 1.324 -0.521 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.046 177.806 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 85.8 m -78.53 -39.47 37.85 Favored 'General case' 0 C--O 1.221 -0.425 0 CA-C-N 118.48 0.582 . . . . 0.0 109.676 -179.801 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.55 HD23 HD11 ' A' ' 526' ' ' ILE . 44.0 mt -57.7 -34.92 69.96 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-O 120.962 0.41 . . . . 0.0 111.407 178.591 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 57.2 mtmt -63.73 -29.13 70.39 Favored 'General case' 0 C--N 1.324 -0.519 0 O-C-N 121.879 -0.513 . . . . 0.0 111.629 175.232 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 85.4 mttt -74.02 -42.59 60.1 Favored 'General case' 0 N--CA 1.471 0.581 0 O-C-N 122.098 -0.376 . . . . 0.0 111.977 -179.741 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.55 HD11 HD23 ' A' ' 523' ' ' LEU . 0.8 OUTLIER -78.83 -21.64 12.88 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.768 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -178.406 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . 0.417 ' HD3' ' HA ' ' A' ' 540' ' ' ALA . 0.0 OUTLIER -65.02 -11.21 36.52 Favored 'General case' 0 C--O 1.214 -0.78 0 O-C-N 121.97 -0.456 . . . . 0.0 112.097 175.554 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 41.0 ptt85 -122.13 19.44 10.74 Favored 'General case' 0 N--CA 1.471 0.589 0 C-N-CA 122.998 0.519 . . . . 0.0 111.596 175.334 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 11.0 t80 -65.48 120.46 12.9 Favored 'General case' 0 N--CA 1.469 0.486 0 N-CA-C 112.698 0.629 . . . . 0.0 112.698 -175.606 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 94.2 mttt -85.98 -27.92 24.56 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 115.566 1.691 . . . . 0.0 115.566 -177.434 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -64.86 -41.45 95.68 Favored 'General case' 0 C--N 1.327 -0.403 0 CA-C-O 121.245 0.545 . . . . 0.0 111.616 -175.289 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 35.7 m120 -132.35 112.5 12.24 Favored 'General case' 0 C--N 1.323 -0.564 0 N-CA-C 109.174 -0.676 . . . . 0.0 109.174 -178.948 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 9.4 tmtt? -62.62 -33.57 75.28 Favored 'General case' 0 C--O 1.2 -1.508 0 C-N-CA 121.147 -0.221 . . . . 0.0 111.272 -179.314 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.4 t0 -58.17 -41.98 85.01 Favored 'General case' 0 C--N 1.322 -0.599 0 CA-C-O 121.521 0.676 . . . . 0.0 111.34 -179.969 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 94.3 t -60.27 -41.02 85.52 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.486 0 O-C-N 121.876 -0.515 . . . . 0.0 109.618 178.238 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 38.1 ttm -57.8 -47.38 82.73 Favored 'General case' 0 CA--C 1.512 -0.497 0 CA-C-O 120.814 0.34 . . . . 0.0 110.122 179.073 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 5.6 mm-40 -65.24 -48.38 73.51 Favored 'General case' 0 C--N 1.318 -0.789 0 CA-C-N 115.533 -0.758 . . . . 0.0 112.035 -179.458 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.1 tptt -72.03 -37.81 69.68 Favored 'General case' 0 CA--C 1.513 -0.456 0 C-N-CA 118.627 -1.229 . . . . 0.0 111.147 -175.399 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.94 -38.66 83.06 Favored 'General case' 0 C--O 1.213 -0.823 0 N-CA-C 108.395 -0.965 . . . . 0.0 108.395 178.01 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . 0.417 ' HA ' ' HD3' ' A' ' 527' ' ' ARG . . . -66.83 -48.97 67.24 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 114.861 -1.063 . . . . 0.0 113.709 179.425 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.89 -41.83 88.11 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.318 -0.993 . . . . 0.0 108.318 -179.705 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 63.3 t -70.6 -51.03 40.52 Favored 'Isoleucine or valine' 0 C--O 1.21 -1.005 0 CA-C-N 115.88 -0.6 . . . . 0.0 111.593 -178.689 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 45.0 t80 -55.08 -44.74 75.11 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 120.597 0.237 . . . . 0.0 110.486 -177.554 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 20.7 m -67.07 -35.55 80.08 Favored 'General case' 0 C--N 1.325 -0.497 0 C-N-CA 123.019 0.528 . . . . 0.0 110.727 179.409 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 16.0 mtt85 -60.58 -29.3 69.1 Favored 'General case' 0 C--N 1.324 -0.507 0 O-C-N 121.807 -0.558 . . . . 0.0 110.157 175.606 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.947 HD22 HG21 ' A' ' 508' ' ' VAL . 9.4 mt -76.2 -34.44 59.28 Favored 'General case' 0 CA--C 1.497 -1.094 0 N-CA-C 107.669 -1.234 . . . . 0.0 107.669 -175.603 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.77 -31.5 70.85 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 115.01 -0.996 . . . . 0.0 111.061 178.205 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 19.6 m -79.6 -13.61 59.4 Favored 'General case' 0 C--N 1.319 -0.73 0 N-CA-C 112.474 0.546 . . . . 0.0 112.474 176.908 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 92.5 mtt-85 -101.97 -31.11 10.83 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 112.618 0.599 . . . . 0.0 112.618 -179.398 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . 173.87 152.38 8.91 Favored Glycine 0 CA--C 1.519 0.316 0 N-CA-C 114.667 0.627 . . . . 0.0 114.667 179.476 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . 0.464 ' HB2' HD12 ' A' ' 513' ' ' LEU . 2.2 m . . . . . 0 C--O 1.246 0.917 0 N-CA-C 115.999 1.851 . . . . 0.0 115.999 178.832 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 466' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 1.521 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 467' ' ' ALA . . . . . . . . . . . . . . . -70.46 158.51 35.92 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 107.097 -1.446 . . . . 0.0 107.097 176.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 468' ' ' SER . . . . . . . . . . . . . 60.6 m -146.3 143.48 19.19 Favored Pre-proline 0 C--N 1.322 -0.594 0 N-CA-C 107.364 -1.347 . . . . 0.0 107.364 177.727 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 469' ' ' PRO . . . . . . . . . . . . . 72.4 Cg_endo -71.29 149.64 57.59 Favored 'Trans proline' 0 C--O 1.239 0.551 0 N-CA-C 113.966 0.718 . . . . 0.0 113.966 -179.099 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 470' ' ' SER . . . . . . . . . . . . . 14.5 m -71.35 165.61 23.37 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 115.406 -0.816 . . . . 0.0 111.274 179.191 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 471' ' ' VAL . . . . . . . . . . . . . 49.9 t -54.38 -45.19 69.0 Favored 'Isoleucine or valine' 0 C--O 1.209 -1.064 0 N-CA-C 112.296 0.48 . . . . 0.0 112.296 179.652 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 472' ' ' GLU . . . . . 0.416 ' HG2' ' H ' ' A' ' 472' ' ' GLU . 1.0 OUTLIER -64.74 -34.13 77.59 Favored 'General case' 0 C--N 1.317 -0.832 0 N-CA-C 112.181 0.437 . . . . 0.0 112.181 -178.796 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 473' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -68.0 -41.29 82.47 Favored 'General case' 0 C--N 1.323 -0.56 0 N-CA-C 107.747 -1.205 . . . . 0.0 107.747 178.604 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 474' ' ' LYS . . . . . . . . . . . . . 60.8 mtpt -72.35 -32.61 66.63 Favored 'General case' 0 CA--C 1.509 -0.605 0 CA-C-N 114.896 -1.047 . . . . 0.0 110.219 -177.84 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 475' ' ' LEU . . . . . 0.421 HD23 HD21 ' A' ' 503' ' ' LEU . 1.6 tm? -56.61 -38.85 72.63 Favored 'General case' 0 C--N 1.32 -0.716 0 CA-C-N 115.477 -0.783 . . . . 0.0 109.186 178.846 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 476' ' ' GLN . . . . . . . . . . . . . 92.2 mt-30 -53.42 -40.45 65.15 Favored 'General case' 0 C--N 1.326 -0.422 0 CA-C-N 118.345 0.52 . . . . 0.0 110.654 -179.065 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 477' ' ' LYS . . . . . . . . . . . . . 56.8 tttt -67.36 -56.68 8.7 Favored 'General case' 0 C--O 1.219 -0.506 0 N-CA-C 110.368 -0.234 . . . . 0.0 110.368 176.856 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 478' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -45.91 89.89 Favored 'General case' 0 CA--C 1.505 -0.751 0 N-CA-C 113.784 1.031 . . . . 0.0 113.784 -176.119 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 479' ' ' HIS . . . . . . . . . . . . . 15.9 t-160 -60.37 -43.32 96.67 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 108.804 -0.813 . . . . 0.0 108.804 -179.739 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 480' ' ' SER . . . . . . . . . . . . . 67.4 m -62.17 -40.47 96.13 Favored 'General case' 0 C--N 1.329 -0.303 0 C-N-CA 120.521 -0.472 . . . . 0.0 110.644 -178.574 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 481' ' ' GLU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 499' ' ' ALA . 12.7 mm-40 -63.01 -38.72 92.33 Favored 'General case' 0 CA--C 1.508 -0.662 0 C-N-CA 120.88 -0.328 . . . . 0.0 111.402 178.61 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 482' ' ' ILE . . . . . . . . . . . . . 96.3 mt -60.23 -43.57 93.64 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.11 0 N-CA-C 106.923 -1.51 . . . . 0.0 106.923 179.472 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 483' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.41 -41.95 93.06 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.161 0.43 . . . . 0.0 112.161 -178.524 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 484' ' ' PHE . . . . . . . . . . . . . 21.3 m-85 -65.73 -34.33 77.93 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-O 120.801 0.334 . . . . 0.0 110.875 179.623 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 485' ' ' ALA . . . . . . . . . . . . . . . -65.35 -17.13 64.28 Favored 'General case' 0 C--N 1.322 -0.604 0 N-CA-C 112.637 0.606 . . . . 0.0 112.637 179.398 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 486' ' ' LEU . . . . . 0.427 HD11 ' CG2' ' A' ' 526' ' ' ILE . 25.8 mt -108.59 12.14 26.17 Favored 'General case' 0 C--N 1.323 -0.546 0 N-CA-C 112.406 0.521 . . . . 0.0 112.406 -178.614 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 487' ' ' LYS . . . . . . . . . . . . . 6.0 mtpt -54.88 130.97 43.25 Favored 'General case' 0 C--O 1.209 -1.068 0 N-CA-C 106.455 -1.683 . . . . 0.0 106.455 177.729 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 488' ' ' VAL . . . . . . . . . . . . . 48.0 t -63.75 -41.17 91.67 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.791 0 CA-C-O 122.468 1.127 . . . . 0.0 108.129 177.507 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 489' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -67.54 -28.95 68.23 Favored 'General case' 0 C--N 1.318 -0.778 0 CA-C-N 113.465 -1.698 . . . . 0.0 113.632 -179.337 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 490' ' ' SER . . . . . . . . . . . . . 9.3 t -159.75 76.08 2.99 Favored Pre-proline 0 C--N 1.324 -0.508 0 N-CA-C 113.444 0.905 . . . . 0.0 113.444 -177.799 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 491' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -75.56 144.5 28.53 Favored 'Trans proline' 0 CA--C 1.535 0.526 0 C-N-CA 116.6 -1.8 . . . . 0.0 113.535 179.407 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 492' ' ' ASP . . . . . . . . . . . . . 66.9 t0 -137.08 104.27 5.38 Favored 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 121.277 0.561 . . . . 0.0 111.099 179.477 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 493' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -60.04 -46.09 94.69 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.774 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -178.934 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 494' ' ' LYS . . . . . . . . . . . . . 95.0 mttt -57.02 -32.67 66.39 Favored 'General case' 0 CA--C 1.504 -0.823 0 CA-C-O 120.96 0.41 . . . . 0.0 109.931 -177.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 495' ' ' ARG . . . . . . . . . . . . . 62.0 ttt180 -70.12 -40.29 74.94 Favored 'General case' 0 C--N 1.322 -0.617 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 -176.234 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 496' ' ' CYS . . . . . 0.429 ' O ' HD22 ' A' ' 500' ' ' LEU . 0.5 OUTLIER -64.95 -49.04 71.91 Favored 'General case' 0 C--O 1.216 -0.693 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 176.007 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 497' ' ' LEU . . . . . . . . . . . . . 74.9 mt -57.31 -44.1 83.85 Favored 'General case' 0 N--CA 1.475 0.819 0 N-CA-C 112.494 0.553 . . . . 0.0 112.494 -175.998 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 498' ' ' ASN . . . . . . . . . . . . . 1.8 t30 -62.62 -40.15 96.04 Favored 'General case' 0 C--N 1.322 -0.6 0 CA-C-O 121.76 0.791 . . . . 0.0 110.336 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 499' ' ' ALA . . . . . 0.418 ' HB2' ' HB2' ' A' ' 481' ' ' GLU . . . -68.91 -46.92 67.07 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-O 121.361 0.6 . . . . 0.0 110.49 179.39 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 500' ' ' LEU . . . . . 0.429 HD22 ' O ' ' A' ' 496' ' ' CYS . 0.0 OUTLIER -55.88 -48.64 75.22 Favored 'General case' 0 N--CA 1.427 -1.618 0 CA-C-N 115.329 -0.85 . . . . 0.0 110.477 179.139 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 501' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -63.02 -35.62 80.83 Favored 'General case' 0 C--N 1.32 -0.678 0 N-CA-C 113.779 1.029 . . . . 0.0 113.779 -175.483 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 502' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -69.98 -43.27 71.81 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.002 -1.11 . . . . 0.0 108.002 176.707 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 503' ' ' LEU . . . . . 0.421 HD21 HD23 ' A' ' 475' ' ' LEU . 1.5 tm? -59.29 -34.74 72.65 Favored 'General case' 0 C--N 1.326 -0.416 0 CA-C-O 121.343 0.592 . . . . 0.0 110.336 -179.338 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 504' ' ' GLY . . . . . . . . . . . . . . . -64.17 -17.98 62.09 Favored Glycine 0 N--CA 1.451 -0.321 0 CA-C-O 119.207 -0.774 . . . . 0.0 114.745 179.78 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 505' ' ' THR . . . . . . . . . . . . . 13.3 t -112.95 -7.7 13.71 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 118.149 0.975 . . . . 0.0 111.064 -179.449 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 506' ' ' LEU . . . . . . . . . . . . . 2.5 mt -72.72 148.57 44.55 Favored 'General case' 0 CA--C 1.539 0.526 0 N-CA-C 108.646 -0.872 . . . . 0.0 108.646 178.523 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 507' ' ' GLN . . . . . 0.454 ' O ' HD13 ' A' ' 512' ' ' ILE . 34.4 tt0 -78.57 84.58 4.68 Favored 'General case' 0 C--O 1.217 -0.613 0 CA-C-O 122.807 1.289 . . . . 0.0 109.985 178.388 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 508' ' ' VAL . . . . . 0.926 HG21 HD22 ' A' ' 546' ' ' LEU . 26.8 m -97.07 46.83 0.1 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.325 0 CA-C-O 122.748 1.261 . . . . 0.0 108.939 -178.181 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 509' ' ' THR . . . . . . . . . . . . . 11.0 t -67.28 172.43 4.81 Favored 'General case' 0 C--N 1.316 -0.871 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -178.244 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 510' ' ' SER . . . . . . . . . . . . . 15.7 m -49.36 -32.15 10.78 Favored 'General case' 0 C--O 1.216 -0.701 0 N-CA-C 113.556 0.947 . . . . 0.0 113.556 -173.949 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 511' ' ' GLN . . . . . . . . . . . . . 58.6 tt0 -55.36 -45.3 76.52 Favored 'General case' 0 C--N 1.324 -0.506 0 O-C-N 122.348 -0.22 . . . . 0.0 111.528 177.799 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 512' ' ' ILE . . . . . 0.454 HD13 ' O ' ' A' ' 507' ' ' GLN . 4.5 mp -86.86 -42.39 15.43 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.5 0 N-CA-C 109.168 -0.678 . . . . 0.0 109.168 179.818 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 513' ' ' LEU . . . . . 0.444 HD23 ' HB ' ' A' ' 508' ' ' VAL . 0.0 OUTLIER -58.08 -40.13 80.3 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 113.55 0.944 . . . . 0.0 113.55 -175.715 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 514' ' ' GLN . . . . . . . . . . . . . 62.0 mt-30 -69.55 -29.43 67.01 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 116.518 -0.31 . . . . 0.0 111.354 -177.654 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 515' ' ' LYS . . . . . . . . . . . . . 19.3 ptmt -90.53 -3.34 57.67 Favored 'General case' 0 N--CA 1.47 0.567 0 O-C-N 122.338 -0.227 . . . . 0.0 110.979 177.537 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 516' ' ' ASN . . . . . . . . . . . . . 44.4 m-80 -128.76 45.3 2.81 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 121.71 0.767 . . . . 0.0 112.388 179.382 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 517' ' ' THR . . . . . . . . . . . . . 22.3 p -64.66 -27.35 68.86 Favored 'General case' 0 C--N 1.322 -0.592 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -178.881 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 518' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -67.39 -24.59 65.7 Favored 'General case' 0 N--CA 1.475 0.819 0 CA-C-O 122.1 0.952 . . . . 0.0 112.207 178.167 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 519' ' ' VAL . . . . . . . . . . . . . 61.5 t -71.74 -45.98 63.65 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.818 0 N-CA-C 106.304 -1.739 . . . . 0.0 106.304 178.363 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 520' ' ' VAL . . . . . . . . . . . . . 21.8 t -62.82 -35.54 71.45 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.521 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 178.846 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 521' ' ' ALA . . . . . . . . . . . . . . . -58.21 -46.1 86.46 Favored 'General case' 0 CA--C 1.512 -0.506 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 176.46 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 522' ' ' THR . . . . . . . . . . . . . 91.7 m -71.2 -39.15 71.97 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 120.46 -0.496 . . . . 0.0 110.641 -175.331 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 523' ' ' LEU . . . . . 0.668 HD23 HD11 ' A' ' 526' ' ' ILE . 72.7 mt -57.61 -35.47 70.5 Favored 'General case' 0 C--N 1.322 -0.588 0 CA-C-O 120.884 0.373 . . . . 0.0 111.186 179.044 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 524' ' ' LYS . . . . . . . . . . . . . 53.4 mtmt -66.06 -29.12 69.41 Favored 'General case' 0 C--N 1.326 -0.446 0 O-C-N 121.789 -0.569 . . . . 0.0 112.382 176.912 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 525' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -73.92 -53.11 10.84 Favored 'General case' 0 CA--C 1.508 -0.664 0 CA-C-O 121.826 0.822 . . . . 0.0 110.419 179.633 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 526' ' ' ILE . . . . . 0.668 HD11 HD23 ' A' ' 523' ' ' LEU . 22.6 pt -65.47 -24.64 35.15 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.929 0 N-CA-C 114.777 1.399 . . . . 0.0 114.777 -179.419 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 527' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -63.28 -16.92 61.79 Favored 'General case' 0 C--O 1.213 -0.842 0 N-CA-C 113.054 0.761 . . . . 0.0 113.054 176.004 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 528' ' ' ARG . . . . . . . . . . . . . 17.5 ptm180 -118.73 19.2 13.24 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 122.791 0.437 . . . . 0.0 111.111 177.072 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 529' ' ' TYR . . . . . . . . . . . . . 26.9 t80 -65.72 120.86 13.75 Favored 'General case' 0 C--N 1.323 -0.563 0 C-N-CA 123.201 0.6 . . . . 0.0 111.462 -179.027 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 530' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -91.5 -19.42 22.82 Favored 'General case' 0 C--O 1.218 -0.592 0 N-CA-C 115.358 1.614 . . . . 0.0 115.358 -178.126 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 531' ' ' ALA . . . . . . . . . . . . . . . -69.49 -22.81 63.58 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 120.191 -0.604 . . . . 0.0 111.129 -177.754 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 532' ' ' ASN . . . . . . . . . . . . . 1.4 t-20 -150.68 128.98 12.0 Favored 'General case' 0 C--N 1.328 -0.34 0 C-N-CA 120.81 -0.356 . . . . 0.0 111.749 174.774 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 533' ' ' LYS . . . . . . . . . . . . . 45.8 tptt -64.28 -49.5 71.59 Favored 'General case' 0 C--O 1.212 -0.91 0 CA-C-N 115.938 -0.574 . . . . 0.0 111.222 -178.454 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 534' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -58.17 -38.36 76.49 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-O 121.251 0.548 . . . . 0.0 111.808 -173.839 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 535' ' ' VAL . . . . . . . . . . . . . 54.8 t -55.95 -44.9 79.62 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.496 0 N-CA-C 109.786 -0.45 . . . . 0.0 109.786 176.873 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 536' ' ' MET . . . . . . . . . . . . . 2.6 ttp -68.32 -43.26 77.97 Favored 'General case' 0 C--N 1.323 -0.562 0 CA-C-O 119.256 -0.402 . . . . 0.0 110.362 179.431 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 537' ' ' GLU . . . . . . . . . . . . . 7.2 mm-40 -64.36 -47.78 78.03 Favored 'General case' 0 C--N 1.323 -0.559 0 C-N-CA 120.406 -0.518 . . . . 0.0 112.354 -179.411 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 538' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -69.82 -38.09 76.46 Favored 'General case' 0 CA--C 1.514 -0.426 0 C-N-CA 119.537 -0.865 . . . . 0.0 110.42 -178.3 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 539' ' ' ALA . . . . . . . . . . . . . . . -59.2 -40.73 86.7 Favored 'General case' 0 CA--C 1.503 -0.831 0 CA-C-O 121.619 0.723 . . . . 0.0 109.287 178.133 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 540' ' ' ALA . . . . . . . . . . . . . . . -66.02 -47.61 73.87 Favored 'General case' 0 C--N 1.311 -1.066 0 CA-C-N 114.524 -1.217 . . . . 0.0 112.638 -179.923 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 541' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.17 -42.48 90.87 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.454 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 542' ' ' VAL . . . . . . . . . . . . . 53.2 t -70.5 -51.11 40.34 Favored 'Isoleucine or valine' 0 C--O 1.21 -0.994 0 CA-C-N 115.994 -0.548 . . . . 0.0 111.414 -178.317 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 543' ' ' TYR . . . . . . . . . . . . . 53.0 t80 -54.49 -45.09 73.15 Favored 'General case' 0 C--N 1.321 -0.662 0 N-CA-C 110.189 -0.3 . . . . 0.0 110.189 -177.781 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 544' ' ' THR . . . . . . . . . . . . . 18.9 m -66.19 -35.11 79.59 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-O 121.297 0.57 . . . . 0.0 111.262 179.978 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 545' ' ' ARG . . . . . . . . . . . . . 23.1 mtt85 -61.65 -30.07 70.48 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.783 -0.573 . . . . 0.0 109.947 174.933 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 546' ' ' LEU . . . . . 0.926 HD22 HG21 ' A' ' 508' ' ' VAL . 8.5 mt -76.68 -34.05 58.22 Favored 'General case' 0 CA--C 1.496 -1.119 0 N-CA-C 107.944 -1.132 . . . . 0.0 107.944 -175.754 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 547' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.06 -28.14 68.85 Favored 'General case' 0 C--O 1.217 -0.639 0 CA-C-N 115.031 -0.986 . . . . 0.0 111.67 178.212 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 548' ' ' SER . . . . . . . . . . . . . 20.9 m -78.27 -8.52 58.47 Favored 'General case' 0 C--N 1.316 -0.865 0 CA-C-N 114.92 -1.037 . . . . 0.0 111.991 177.769 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 549' ' ' ARG . . . . . . . . . . . . . 64.1 mtt85 -116.87 -19.19 9.96 Favored 'General case' 0 N--CA 1.476 0.875 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -179.696 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 550' ' ' GLY . . . . . . . . . . . . . . . -170.82 157.93 29.24 Favored Glycine 0 CA--C 1.518 0.281 0 N-CA-C 109.467 -1.453 . . . . 0.0 109.467 -179.971 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 551' ' ' SER . . . . . . . . . . . . . 12.9 m . . . . . 0 C--O 1.242 0.662 0 N-CA-C 113.684 0.994 . . . . 0.0 113.684 -176.686 . . . . . . . . 0 0 . 1 stop_ save_